data_2lva_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 2lva _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 ' 23' ' ' MET . . . . . . . . . . . . . 54.7 ttm . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.529 HD11 ' HG ' ' A' ' 44' ' ' LEU . 2.6 pt? -63.42 -37.26 86.59 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.474 HD11 ' HB2' ' A' ' 40' ' ' LEU . 3.0 mm? -68.17 -44.48 75.83 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -65.84 -46.87 76.93 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.244 0.965 . . . . 0.0 111.044 -176.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.413 ' O ' HG12 ' A' ' 31' ' ' ILE . 4.6 mm100 -59.63 -56.42 22.12 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 124.699 1.249 . . . . 0.0 110.858 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.477 HD23 ' HA ' ' A' ' 40' ' ' LEU . 18.7 tp -56.98 -48.26 78.83 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 124.095 0.872 . . . . 0.0 110.868 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -55.1 -41.93 72.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.751 0.82 . . . . 0.0 111.434 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.55 -44.05 83.42 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.234 1.014 . . . . 0.0 109.948 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.7 pt -97.66 2.26 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -171.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.513 HG23 HD12 ' A' ' 58' ' ' LEU . 68.0 p -114.11 -49.6 2.85 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 170.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 111.69 -10.59 27.87 Favored Glycine 0 C--N 1.338 0.68 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.784 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.658 HD12 HD11 ' A' ' 58' ' ' LEU . 90.5 mt -71.32 119.86 18.41 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 C-N-CA 123.399 0.68 . . . . 0.0 110.652 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -86.37 -20.63 27.99 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.139 0.976 . . . . 0.0 111.685 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.405 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.8 t70 -70.81 114.46 26.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.194 0.598 . . . . 0.0 110.405 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.08 -30.52 65.83 Favored 'Trans proline' 0 C--N 1.382 2.299 0 C-N-CA 122.735 2.29 . . . . 0.0 113.24 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.5 t -68.66 -43.13 76.87 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.746 0.419 . . . . 0.0 110.114 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -60.34 -32.09 70.92 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.524 1.129 . . . . 0.0 110.662 -179.089 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 mt -70.42 -48.72 54.75 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.587 178.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -55.43 -47.01 76.63 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.838 173.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.33 -28.48 67.19 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.553 0.741 . . . . 0.0 111.932 -173.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.98 -46.68 67.46 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 123.541 0.526 . . . . 0.0 110.831 172.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.529 ' HG ' HD11 ' A' ' 24' ' ' LEU . 4.0 mm? -61.68 -31.54 71.68 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.717 0.807 . . . . 0.0 110.632 175.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -74.52 -38.36 62.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.8 0.84 . . . . 0.0 110.758 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.15 -33.11 69.74 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.62 0.768 . . . . 0.0 111.036 -178.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.1 p -91.03 2.2 56.5 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.936 0.894 . . . . 0.0 111.474 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 66.8 t30 63.21 16.79 9.69 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.657 1.183 . . . . 0.0 111.946 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 125.92 -25.45 5.54 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.395 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -74.86 106.86 6.59 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.306 0.553 . . . . 0.0 110.536 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.443 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.8 tt -68.89 -27.9 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.055 0.542 . . . . 0.0 112.079 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -66.66 -46.33 76.05 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.469 0.707 . . . . 0.0 110.637 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.5 mm-40 -62.52 -37.28 85.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.612 173.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.66 87.87 Favored 'General case' 0 C--O 1.244 0.763 0 C-N-CA 123.523 0.729 . . . . 0.0 111.001 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.1 t -60.8 -51.24 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 123.709 0.631 . . . . 0.0 110.165 174.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -55.04 -39.32 69.02 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 124.386 1.054 . . . . 0.0 111.538 -177.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 91.8 mt -73.4 -37.07 66.07 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.399 -178.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.658 HD11 HD12 ' A' ' 34' ' ' ILE . 50.0 mt -74.11 -33.36 63.56 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 120.55 0.214 . . . . 0.0 111.484 177.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.4 p . . . . . 0 CA--C 1.546 0.796 0 C-N-CA 123.096 0.558 . . . . 0.0 111.175 -179.603 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 C--O 1.243 0.738 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -29.04 64.94 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.07 0.395 . . . . 0.0 111.0 -177.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -64.19 -52.68 57.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.025 0.53 . . . . 0.0 110.468 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.01 -23.22 61.36 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.156 0.91 . . . . 0.0 111.4 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.38 -52.98 21.88 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.939 0.496 . . . . 0.0 111.025 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.8 mm -64.01 -43.23 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.718 0.807 . . . . 0.0 109.611 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.74 -41.71 95.91 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.03 0.932 . . . . 0.0 110.911 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 tt -66.16 -44.82 82.99 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.861 0.865 . . . . 0.0 110.213 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -64.39 -34.4 78.08 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.489 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.549 0.925 0 C-N-CA 123.203 0.601 . . . . 0.0 110.869 178.33 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.588 ' HG ' HD23 ' A' ' 25' ' ' LEU . 2.5 pt? -70.48 -38.16 74.35 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.659 0.784 . . . . 0.0 111.926 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.588 HD23 ' HG ' ' A' ' 24' ' ' LEU . 4.0 mm? -65.67 -53.19 44.54 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.824 0.449 . . . . 0.0 110.072 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -65.05 -41.41 95.19 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.968 1.418 . . . . 0.0 111.66 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -57.83 -51.49 69.38 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.802 0.441 . . . . 0.0 110.125 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.475 ' HA ' HG12 ' A' ' 31' ' ' ILE . 14.4 tp -63.08 -37.32 86.72 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 123.697 0.623 . . . . 0.0 110.821 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 20.2 ttp180 -63.02 -39.34 94.46 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.147 0.979 . . . . 0.0 110.62 -176.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.56 -20.18 34.27 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.422 -177.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.475 HG12 ' HA ' ' A' ' 28' ' ' LEU . 17.1 pt -99.4 -8.32 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 176.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.488 HG22 HD12 ' A' ' 58' ' ' LEU . 69.2 p -108.54 -48.12 3.38 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.06 0.544 . . . . 0.0 110.675 174.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.84 -16.44 28.24 Favored Glycine 0 N--CA 1.467 0.74 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.81 -175.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.643 HD11 HD11 ' A' ' 58' ' ' LEU . 57.0 mt -72.68 107.23 3.26 Favored 'Isoleucine or valine' 0 C--N 1.357 0.91 0 C-N-CA 124.039 0.935 . . . . 0.0 110.238 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -78.77 -1.69 35.95 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.025 0.93 . . . . 0.0 111.793 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -88.21 104.49 7.09 Favored Pre-proline 0 N--CA 1.474 0.751 0 C-N-CA 123.955 0.902 . . . . 0.0 109.656 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HA ' HD11 ' A' ' 40' ' ' LEU . 37.3 Cg_endo -63.16 -25.42 72.72 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.069 2.513 . . . . 0.0 113.027 -176.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -60.44 -43.7 96.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.591 0.757 . . . . 0.0 111.631 178.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -70.87 -29.47 65.58 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 123.307 0.643 . . . . 0.0 110.432 -178.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.502 HD11 ' HA ' ' A' ' 37' ' ' PRO . 32.9 mt -72.58 -37.02 68.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.437 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -62.3 -44.3 96.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.202 0.601 . . . . 0.0 110.764 172.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.498 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.0 mt-10 -60.88 -39.79 90.55 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.564 0.746 . . . . 0.0 111.657 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.63 -44.51 77.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 123.648 0.592 . . . . 0.0 111.245 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.49 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -69.14 -26.01 64.66 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.139 0.976 . . . . 0.0 111.162 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 1.9 tmmm? -77.13 -42.71 36.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.791 0.837 . . . . 0.0 109.677 177.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.27 -36.36 77.03 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.573 0.749 . . . . 0.0 110.406 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.402 ' HG ' ' HB3' ' A' ' 54' ' ' ALA . 97.7 p -87.79 -5.25 58.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.531 0.732 . . . . 0.0 111.323 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.9 m120 64.68 24.02 12.87 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.545 1.138 . . . . 0.0 112.106 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.49 -2.88 30.87 Favored Glycine 0 C--N 1.347 1.143 0 CA-C-N 115.959 -0.564 . . . . 0.0 113.203 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -86.15 100.25 12.08 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.2 tt -66.62 -24.82 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.141 0.576 . . . . 0.0 112.146 -172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.8 m -67.93 -45.76 73.4 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.507 0.723 . . . . 0.0 110.191 176.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -70.22 -29.97 66.93 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.875 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.402 ' HB3' ' HG ' ' A' ' 47' ' ' SER . . . -64.9 -51.48 61.72 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 123.442 0.697 . . . . 0.0 111.375 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.25 -38.96 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.022 177.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -54.29 -47.54 72.26 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 124.355 1.035 . . . . 0.0 110.297 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.21 -45.28 92.38 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 123.759 0.662 . . . . 0.0 111.311 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.643 HD11 HD11 ' A' ' 34' ' ' ILE . 84.6 mt -71.06 -15.48 62.54 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.583 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 68.0 p . . . . . 0 N--CA 1.49 1.563 0 C-N-CA 122.986 0.514 . . . . 0.0 112.216 176.344 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.72 60.95 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.115 0.416 . . . . 0.0 111.436 -177.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.61 -42.75 88.87 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 170.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.29 -38.9 78.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.94 0.896 . . . . 0.0 110.726 -178.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.31 84.19 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.182 0.926 . . . . 0.0 111.397 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.14 -46.21 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.42 0.688 . . . . 0.0 110.195 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.48 81.09 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.656 0.782 . . . . 0.0 111.216 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.1 tp -66.46 -52.14 49.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.479 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.8 m -68.35 -26.47 65.61 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -172.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 122.651 0.38 . . . . 0.0 111.216 -179.767 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.3 tmm? . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 119.69 -0.195 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.609 ' HG ' HD23 ' A' ' 25' ' ' LEU . 1.2 pt? -56.39 -35.59 67.92 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.463 0.705 . . . . 0.0 111.886 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.609 HD23 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -61.74 -62.81 1.54 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.33 0.652 . . . . 0.0 109.632 178.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.48 -43.12 95.16 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 124.813 1.321 . . . . 0.0 111.401 -171.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.463 ' O ' HG12 ' A' ' 31' ' ' ILE . 7.1 mm100 -66.07 -52.12 51.77 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.748 -178.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.567 HD23 ' HA ' ' A' ' 40' ' ' LEU . 20.6 tp -62.5 -44.66 95.83 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -57.98 -31.33 66.8 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.666 1.186 . . . . 0.0 111.77 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -71.77 -52.2 18.84 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.313 0.645 . . . . 0.0 110.496 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 27' ' ' GLN . 15.1 pt -89.65 3.45 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 p -114.41 -51.25 2.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 167.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.53 -2.05 34.47 Favored Glycine 0 C--N 1.341 0.844 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.836 -175.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.469 HD11 HD11 ' A' ' 58' ' ' LEU . 81.7 mt -82.21 120.68 34.15 Favored 'Isoleucine or valine' 0 C--N 1.351 0.67 0 C-N-CA 123.579 0.751 . . . . 0.0 110.58 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -79.98 -26.27 40.01 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.39 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 7.4 m-20 -64.24 110.69 4.21 Favored Pre-proline 0 N--CA 1.479 1.012 0 C-N-CA 124.668 1.187 . . . . 0.0 111.225 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.21 -26.23 57.06 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.833 2.355 . . . . 0.0 112.378 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 m -58.16 -52.14 66.78 Favored 'General case' 0 C--N 1.356 0.87 0 C-N-CA 123.739 0.816 . . . . 0.0 110.113 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -57.35 -37.59 72.8 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.274 0.984 . . . . 0.0 110.991 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.567 ' HA ' HD23 ' A' ' 28' ' ' LEU . 58.7 mt -70.7 -48.48 54.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 124.172 0.92 . . . . 0.0 111.486 -174.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -68.71 -38.91 80.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.929 0.492 . . . . 0.0 111.23 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.561 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.4 mt-10 -68.1 -37.25 80.98 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.226 0.61 . . . . 0.0 111.754 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.43 -43.81 72.62 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.797 0.686 . . . . 0.0 110.685 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.525 ' HG ' ' HB2' ' A' ' 24' ' ' LEU . 3.4 mm? -62.84 -35.74 80.93 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.96 0.904 . . . . 0.0 111.03 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.2 tmmm? -68.19 -47.1 68.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.708 0.803 . . . . 0.0 110.464 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.09 -19.89 61.06 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.771 0.828 . . . . 0.0 111.74 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.6 p -96.67 -0.71 48.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.455 0.702 . . . . 0.0 111.292 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 64.51 21.9 12.56 Favored 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 124.761 1.225 . . . . 0.0 111.089 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -16.18 24.98 Favored Glycine 0 C--N 1.348 1.225 0 CA-C-N 115.978 -0.555 . . . . 0.0 113.306 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -76.97 102.35 6.38 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-N 117.328 0.564 . . . . 0.0 110.459 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.9 tt -60.24 -25.72 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.665 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 29.0 m -67.86 -47.78 67.94 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.15 0.58 . . . . 0.0 110.709 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.42 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 7.9 mm-40 -65.47 -34.73 78.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.543 0.337 . . . . 0.0 110.657 175.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.16 -42.34 90.5 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.362 0.665 . . . . 0.0 110.885 178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.24 -52.15 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 123.798 0.686 . . . . 0.0 109.723 171.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.4 m -56.76 -33.26 66.42 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.126 0.892 . . . . 0.0 112.434 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -79.7 -36.17 37.96 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.567 0.747 . . . . 0.0 111.177 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.469 HD11 HD11 ' A' ' 34' ' ' ILE . 68.4 mt -76.0 -25.2 55.54 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 175.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.472 0.661 0 C-N-CA 123.42 0.688 . . . . 0.0 111.426 179.369 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 N--CA 1.475 0.792 0 CA-C-O 120.865 0.365 . . . . 0.0 111.409 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -22.96 61.4 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.509 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -58.84 -47.07 86.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -34.76 72.91 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.19 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.05 77.33 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.474 0.71 . . . . 0.0 111.735 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.99 -41.36 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 123.568 0.747 . . . . 0.0 110.484 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.84 -51.8 66.76 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.663 0.602 . . . . 0.0 110.489 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 34.6 tp -61.33 -40.4 94.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.324 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -59.6 -40.02 86.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.487 0.715 . . . . 0.0 111.469 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.9 tt . . . . . 0 N--CA 1.477 0.877 0 C-N-CA 123.576 0.751 . . . . 0.0 109.645 178.412 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.515 HD11 ' HG ' ' A' ' 44' ' ' LEU . 2.2 pt? -59.17 -39.49 82.66 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.648 0.779 . . . . 0.0 112.737 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -70.54 -37.63 74.08 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.328 0.251 . . . . 0.0 110.371 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.85 -45.26 90.28 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.259 0.975 . . . . 0.0 110.211 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -62.24 -51.32 68.23 Favored 'General case' 0 C--N 1.349 0.564 0 O-C-N 124.422 1.077 . . . . 0.0 110.822 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' A' ' 40' ' ' LEU . 14.7 tp -63.79 -44.21 94.01 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.891 0.745 . . . . 0.0 110.629 -176.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttt-85 -54.25 -41.81 69.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.274 1.03 . . . . 0.0 110.933 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.1 -34.69 61.76 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.449 -174.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.06 -9.08 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.411 HG22 HG21 ' A' ' 55' ' ' VAL . 72.3 p -102.37 -53.51 2.88 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 171.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.49 -11.44 25.94 Favored Glycine 0 N--CA 1.47 0.911 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.243 -172.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.442 HD12 HD11 ' A' ' 58' ' ' LEU . 78.9 mt -73.95 118.82 20.06 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 110.151 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -85.04 -22.5 28.98 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.963 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -62.39 111.87 5.45 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.866 0.866 . . . . 0.0 110.688 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -62.47 -32.75 80.36 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 122.894 2.396 . . . . 0.0 112.509 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.2 m -54.47 -50.8 66.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.638 0.775 . . . . 0.0 110.79 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -57.0 -37.84 72.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.233 1.013 . . . . 0.0 111.146 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.57 ' HA ' HD22 ' A' ' 28' ' ' LEU . 40.5 mt -72.63 -50.85 22.43 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.777 -1.102 . . . . 0.0 111.293 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -60.74 -44.97 96.02 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.477 0.711 . . . . 0.0 111.205 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -66.02 -36.5 83.42 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.014 0.926 . . . . 0.0 112.086 -178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.8 -41.94 70.95 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.125 0.265 . . . . 0.0 110.423 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.515 ' HG ' HD11 ' A' ' 24' ' ' LEU . 2.4 mm? -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.945 0.898 . . . . 0.0 110.59 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.6 pttt -77.29 -32.23 55.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.549 0.339 . . . . 0.0 110.506 -174.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.67 -24.98 60.05 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.013 0.525 . . . . 0.0 111.187 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.4 p -93.26 3.28 55.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.771 0.828 . . . . 0.0 111.217 175.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 t30 72.04 7.2 5.75 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.348 1.459 . . . . 0.0 112.041 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 21.47 4.51 Favored Glycine 0 N--CA 1.473 1.148 0 C-N-CA 123.578 0.609 . . . . 0.0 112.106 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -104.38 116.5 32.24 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.402 0.681 . . . . 0.0 109.462 -174.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 7.8 tp -65.39 -32.88 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.154 0.582 . . . . 0.0 111.888 -175.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -75.52 -41.66 54.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.697 0.799 . . . . 0.0 111.379 -175.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -75.1 -27.65 59.94 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.351 -0.218 . . . . 0.0 110.59 176.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.29 71.0 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.227 0.611 . . . . 0.0 111.256 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.411 HG21 HG22 ' A' ' 32' ' ' THR . 13.7 p -65.84 -34.4 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.713 0.405 . . . . 0.0 109.998 176.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.0 t -63.5 -39.2 93.82 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 123.806 0.691 . . . . 0.0 111.524 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.25 -31.92 66.22 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.689 . . . . 0.0 111.518 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.442 HD11 HD12 ' A' ' 34' ' ' ILE . 57.7 mt -81.84 -26.8 33.96 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p . . . . . 0 N--CA 1.482 1.134 0 CA-C-N 117.987 0.358 . . . . 0.0 110.968 175.626 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -34.28 76.99 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.164 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -62.42 -39.38 93.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.596 0.758 . . . . 0.0 110.577 175.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.66 -42.46 67.5 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.253 0.971 . . . . 0.0 110.747 -175.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.43 -45.57 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.988 0.805 . . . . 0.0 111.295 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.8 mm -65.42 -46.24 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.321 0.649 . . . . 0.0 110.467 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.8 78.34 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.539 0.735 . . . . 0.0 111.224 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.98 -47.41 74.63 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -69.26 -24.46 63.98 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -177.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 123.187 0.595 . . . . 0.0 111.429 -179.395 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 51.7 ttm . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.596 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.0 pt? -57.05 -34.98 68.8 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.738 0.815 . . . . 0.0 112.08 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.596 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -64.76 -51.88 59.97 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.859 0.464 . . . . 0.0 110.069 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -62.47 -49.86 73.74 Favored 'General case' 0 N--CA 1.484 1.229 0 O-C-N 124.688 1.242 . . . . 0.0 110.498 -174.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -55.24 -54.96 36.78 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.793 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.559 HD22 ' HA ' ' A' ' 40' ' ' LEU . 14.6 tp -70.73 -40.78 72.56 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 123.342 0.401 . . . . 0.0 111.024 -175.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -54.91 -38.05 67.13 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.179 0.992 . . . . 0.0 111.272 176.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -75.71 -42.07 51.81 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.877 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.453 HG12 ' HA ' ' A' ' 28' ' ' LEU . 27.7 pt -86.23 -10.15 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.445 HG21 HG23 ' A' ' 55' ' ' VAL . 77.6 p -103.77 -50.84 3.31 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.428 0.632 . . . . 0.0 109.868 173.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.52 -4.61 32.9 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.541 -174.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.51 HD11 HD12 ' A' ' 58' ' ' LEU . 73.8 mt -81.0 118.8 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 124.263 1.025 . . . . 0.0 110.4 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -84.12 -18.65 36.13 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.054 -178.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 13.9 t70 -69.06 119.61 71.09 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.53 0.732 . . . . 0.0 110.27 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -69.29 -29.58 25.9 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.766 2.311 . . . . 0.0 113.287 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -63.34 -48.72 76.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.086 0.554 . . . . 0.0 110.242 -176.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -55.46 -38.62 69.31 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 124.257 0.973 . . . . 0.0 111.454 177.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.559 ' HA ' HD22 ' A' ' 28' ' ' LEU . 45.5 mt -69.57 -46.87 65.38 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.872 0.733 . . . . 0.0 110.89 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.12 -43.39 98.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.191 0.596 . . . . 0.0 111.267 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.512 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 49.2 mt-10 -70.75 -30.39 66.89 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.612 0.765 . . . . 0.0 111.833 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.58 -42.99 60.86 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 123.379 0.424 . . . . 0.0 110.347 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.438 ' HG ' HD11 ' A' ' 24' ' ' LEU . 3.5 mm? -66.19 -29.8 70.15 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.826 0.85 . . . . 0.0 110.21 176.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.512 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.3 tmmm? -75.21 -43.28 52.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 110.48 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.15 77.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.331 0.652 . . . . 0.0 110.738 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.9 p -88.53 -6.74 57.4 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.46 0.704 . . . . 0.0 111.405 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 66.48 13.18 9.15 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.083 1.353 . . . . 0.0 111.825 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.01 -14.79 5.42 Favored Glycine 0 C--N 1.351 1.394 0 CA-C-O 119.744 -0.476 . . . . 0.0 113.489 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -78.27 102.49 7.67 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.197 0.499 . . . . 0.0 109.935 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.1 tt -65.04 -27.01 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.5 m -68.26 -41.94 80.34 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 121.428 0.633 . . . . 0.0 110.348 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -72.27 -33.24 67.32 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.4 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.98 -51.05 70.88 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.541 0.736 . . . . 0.0 111.386 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.445 HG23 HG21 ' A' ' 32' ' ' THR . 7.7 p -64.01 -39.81 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.195 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.2 t -60.23 -33.22 71.96 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.525 0.516 . . . . 0.0 111.905 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 99.3 mt -77.93 -36.28 49.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.001 0.52 . . . . 0.0 111.522 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.51 HD12 HD11 ' A' ' 34' ' ' ILE . 73.2 mt -78.32 -18.44 55.19 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.6 p . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 123.205 0.602 . . . . 0.0 111.008 176.875 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -30.52 69.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.225 0.61 . . . . 0.0 112.053 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -65.62 -48.24 72.92 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.028 0.531 . . . . 0.0 110.158 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.04 70.35 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.626 0.579 . . . . 0.0 111.12 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -56.16 20.05 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.085 0.554 . . . . 0.0 111.013 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -72.8 -41.92 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.324 0.65 . . . . 0.0 110.673 -175.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.35 96.15 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.944 0.498 . . . . 0.0 111.554 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.5 tp -63.6 -46.68 84.7 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -59.37 -24.73 63.65 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.17 0.588 . . . . 0.0 112.406 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 C--O 1.244 0.789 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.179 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.7 ttt . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.576 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -56.67 -38.86 72.79 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.728 0.811 . . . . 0.0 112.27 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.576 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -65.3 -46.11 81.71 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -63.23 -44.74 94.39 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 124.418 1.074 . . . . 0.0 111.271 -177.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -55.55 33.4 Favored 'General case' 0 C--N 1.349 0.55 0 O-C-N 124.532 1.145 . . . . 0.0 110.075 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.64 HD21 ' HA ' ' A' ' 40' ' ' LEU . 13.8 tp -66.61 -44.9 80.86 Favored 'General case' 0 C--N 1.351 0.665 0 O-C-N 124.213 0.946 . . . . 0.0 111.125 -174.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -56.93 -38.8 73.39 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.419 1.088 . . . . 0.0 111.605 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -71.62 -49.62 38.46 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.753 0.658 . . . . 0.0 110.641 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.483 HD12 HD13 ' A' ' 28' ' ' LEU . 14.6 pt -74.93 -30.21 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.3 p -87.2 -48.21 8.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.892 0.477 . . . . 0.0 110.152 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.37 4.92 54.82 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.665 -174.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.613 HD12 HD12 ' A' ' 58' ' ' LEU . 72.7 mt -84.85 124.8 40.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.865 0.866 . . . . 0.0 110.463 -177.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -90.21 -12.25 38.61 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.247 1.019 . . . . 0.0 112.61 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.415 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 8.0 m-20 -72.05 109.09 5.03 Favored Pre-proline 0 N--CA 1.475 0.816 0 O-C-N 123.787 0.68 . . . . 0.0 109.688 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -63.73 -28.64 68.64 Favored 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.0 2.466 . . . . 0.0 111.413 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.3 m -58.28 -51.98 67.49 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.118 0.967 . . . . 0.0 110.537 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -60.05 -34.42 73.38 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.718 0.807 . . . . 0.0 111.263 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.64 ' HA ' HD21 ' A' ' 28' ' ' LEU . 51.9 mt -69.88 -52.38 25.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.778 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -57.04 -49.84 74.6 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.751 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.4 -38.91 91.47 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.387 0.675 . . . . 0.0 112.373 -173.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.62 -42.2 82.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.462 0.476 . . . . 0.0 110.809 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.439 HD22 HD22 ' A' ' 28' ' ' LEU . 3.7 mm? -63.76 -32.8 74.42 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.856 0.862 . . . . 0.0 111.31 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 mpmm? -75.75 -41.61 52.76 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.836 0.454 . . . . 0.0 110.461 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.29 -27.28 67.04 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.07 0.948 . . . . 0.0 111.14 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -101.83 -1.63 31.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.792 0.837 . . . . 0.0 111.705 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 m120 64.68 16.97 10.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.964 1.306 . . . . 0.0 112.283 178.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.76 -13.57 13.1 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-O 119.51 -0.605 . . . . 0.0 113.126 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.4 109.05 5.14 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 109.773 -178.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.76 -28.94 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.591 0.756 . . . . 0.0 111.601 -172.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.7 m -71.85 -45.34 61.75 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.092 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.8 mm-40 -65.45 -40.44 93.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.876 0.471 . . . . 0.0 110.158 174.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.1 75.35 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.008 0.923 . . . . 0.0 111.869 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.2 p -64.73 -39.31 85.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.661 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.533 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.8 m -62.34 -36.55 82.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.384 0.673 . . . . 0.0 112.242 178.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.4 mt -71.64 -33.81 69.24 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.448 0.699 . . . . 0.0 111.007 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.613 HD12 HD12 ' A' ' 34' ' ' ILE . 79.6 mt -84.08 -26.68 28.82 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 176.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.8 p . . . . . 0 N--CA 1.483 1.197 0 C-N-CA 123.098 0.559 . . . . 0.0 110.799 178.785 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.7 t70 . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 120.334 0.112 . . . . 0.0 111.052 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -32.46 73.84 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.297 0.998 . . . . 0.0 111.704 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -58.7 -57.32 13.54 Favored 'General case' 0 C--N 1.359 0.99 0 O-C-N 123.877 0.736 . . . . 0.0 110.368 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.82 -25.44 61.14 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.45 1.094 . . . . 0.0 111.386 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.81 -57.96 8.28 Favored 'General case' 0 C--N 1.354 0.779 0 C-N-CA 123.135 0.574 . . . . 0.0 110.156 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.26 -39.89 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -54.6 -59.1 5.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.021 0.928 . . . . 0.0 110.82 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 43.9 tp -67.73 -34.39 76.75 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.119 0.887 . . . . 0.0 111.398 -177.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.1 t -66.4 -30.16 70.48 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 122.381 0.272 . . . . 0.0 111.443 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 43.3 mt . . . . . 0 CA--C 1.549 0.93 0 C-N-CA 123.769 0.828 . . . . 0.0 110.96 175.436 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.0 tpt . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.504 HD13 ' HG ' ' A' ' 44' ' ' LEU . 2.5 pt? -62.54 -33.54 75.13 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.995 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.2 -49.45 71.95 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.164 0.586 . . . . 0.0 109.938 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -69.3 -42.33 75.59 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.73 -174.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -56.26 -54.34 46.49 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.364 1.065 . . . . 0.0 110.727 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 40' ' ' LEU . 15.2 tp -65.08 -42.2 94.34 Favored 'General case' 0 C--N 1.357 0.922 0 O-C-N 123.496 0.498 . . . . 0.0 111.285 -177.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -57.29 -37.63 72.71 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.209 1.004 . . . . 0.0 111.4 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.45 -48.37 56.27 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.336 0.654 . . . . 0.0 111.161 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 17.7 pt -82.51 -16.18 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 74.9 p -96.05 -48.01 5.86 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.111 0.481 . . . . 0.0 109.874 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -9.87 47.33 Favored Glycine 0 N--CA 1.468 0.816 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.026 -173.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.419 HD12 ' HB3' ' A' ' 58' ' ' LEU . 88.1 mt -75.85 112.11 13.11 Favored 'Isoleucine or valine' 0 C--N 1.348 0.538 0 C-N-CA 124.202 1.001 . . . . 0.0 110.351 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -79.49 -14.92 58.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 9.4 t70 -78.17 116.33 58.03 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.07 0.948 . . . . 0.0 110.336 -175.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.01 -23.43 34.21 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.924 2.416 . . . . 0.0 113.456 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.0 m -62.31 -50.15 72.77 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.073 0.549 . . . . 0.0 110.061 -177.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.8 -38.36 78.42 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 125.112 1.507 . . . . 0.0 111.318 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.507 ' HA ' HD22 ' A' ' 28' ' ' LEU . 43.1 mt -67.67 -46.55 72.03 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.199 0.937 . . . . 0.0 111.111 -176.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -62.27 -46.06 90.49 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.667 0.604 . . . . 0.0 111.022 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.498 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 47.2 mt-10 -65.15 -31.2 72.27 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.497 0.719 . . . . 0.0 112.16 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -43.81 64.58 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.676 0.61 . . . . 0.0 110.43 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.504 ' HG ' HD13 ' A' ' 24' ' ' LEU . 4.2 mm? -68.58 -27.05 65.72 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 0.0 110.349 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.7 tmmm? -75.38 -45.2 40.62 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.255 1.022 . . . . 0.0 110.309 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.22 -30.29 68.42 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.443 0.697 . . . . 0.0 111.274 -177.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.08 2.79 56.06 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.724 0.81 . . . . 0.0 112.123 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 67.65 11.74 8.52 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.842 1.257 . . . . 0.0 111.866 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.05 2.25 22.08 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 123.537 0.589 . . . . 0.0 113.55 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -88.17 110.26 20.55 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.352 0.596 . . . . 0.0 110.666 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.4 tt -67.99 -18.94 24.22 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.798 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 m -71.08 -50.55 32.54 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.456 0.703 . . . . 0.0 111.008 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -64.66 -38.64 91.69 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.903 174.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.68 62.59 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.127 0.892 . . . . 0.0 112.527 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -65.06 -41.15 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 O-C-N 123.583 0.552 . . . . 0.0 110.888 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.8 t -59.41 -42.7 92.4 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.612 0.57 . . . . 0.0 111.227 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 85.9 mt -71.18 -38.14 72.14 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.049 0.54 . . . . 0.0 111.559 -177.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.419 ' HB3' HD12 ' A' ' 34' ' ' ILE . 37.8 mt -76.78 -26.43 54.49 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.48 1.051 0 CA-C-N 118.163 0.438 . . . . 0.0 110.877 179.157 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -32.15 72.44 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.437 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -66.15 -44.85 82.94 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.94 0.496 . . . . 0.0 110.393 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.96 90.54 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.011 0.819 . . . . 0.0 110.677 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -57.76 11.33 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.206 1.003 . . . . 0.0 111.83 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.2 mm -64.47 -42.18 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.926 0.891 . . . . 0.0 111.188 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.78 88.65 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.342 0.657 . . . . 0.0 111.528 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.01 -45.65 80.77 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -67.69 -27.78 67.12 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.614 0.765 . . . . 0.0 111.908 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.9 tt . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 123.85 0.86 . . . . 0.0 109.889 -177.356 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.1 ttt . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.588 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -52.48 -39.86 61.68 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.466 0.707 . . . . 0.0 112.605 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.588 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.1 mm? -62.55 -51.99 65.18 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -60.14 -46.28 90.18 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.553 1.158 . . . . 0.0 111.809 -174.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -62.26 -55.86 24.24 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 124.138 0.899 . . . . 0.0 110.596 -178.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.573 HD21 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -62.38 -49.44 75.54 Favored 'General case' 0 C--N 1.356 0.865 0 O-C-N 123.806 0.691 . . . . 0.0 111.019 -176.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -57.27 -34.4 68.61 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.648 1.179 . . . . 0.0 111.493 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.76 -54.07 26.57 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.558 175.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.0 pt -88.5 -6.47 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -167.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 p -105.49 -40.11 5.9 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.306 0.643 . . . . 0.0 109.535 171.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.72 1.8 67.78 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.982 -176.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.508 HD11 HD11 ' A' ' 58' ' ' LEU . 67.1 mt -78.98 122.21 33.74 Favored 'Isoleucine or valine' 0 C--N 1.348 0.516 0 C-N-CA 123.939 0.896 . . . . 0.0 111.262 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -83.05 -21.0 33.92 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.985 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 10.5 m-20 -66.87 109.13 3.03 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 123.793 0.837 . . . . 0.0 110.061 -177.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -69.17 -29.54 26.51 Favored 'Trans proline' 0 C--N 1.373 1.85 0 C-N-CA 122.512 2.142 . . . . 0.0 111.763 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 m -61.4 -43.07 99.5 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.284 0.634 . . . . 0.0 109.909 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -60.73 -39.15 87.58 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 123.404 0.44 . . . . 0.0 110.36 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.573 ' HA ' HD21 ' A' ' 28' ' ' LEU . 62.0 mt -67.72 -52.85 32.82 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 124.19 0.931 . . . . 0.0 111.499 -175.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -62.36 -49.73 74.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.697 0.399 . . . . 0.0 111.54 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -65.33 -26.77 68.19 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.978 0.511 . . . . 0.0 111.878 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.23 -45.24 70.28 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.618 0.367 . . . . 0.0 110.502 171.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.438 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -66.31 -23.15 66.33 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.555 0.742 . . . . 0.0 111.091 175.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mpmm? -75.62 -45.37 37.81 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.363 0.665 . . . . 0.0 109.425 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -12.88 61.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.861 0.864 . . . . 0.0 112.048 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 98.5 p -110.44 -4.68 15.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.366 0.667 . . . . 0.0 111.725 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 65.05 20.88 12.17 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.551 1.14 . . . . 0.0 112.08 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.88 2.57 32.08 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-O 119.543 -0.587 . . . . 0.0 113.318 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -89.42 115.63 27.01 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.009 0.523 . . . . 0.0 110.305 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.545 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.6 tp -62.38 -39.13 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.468 0.307 . . . . 0.0 111.774 -173.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.1 m -66.05 -47.66 73.64 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.795 0.838 . . . . 0.0 110.89 -172.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -65.44 -36.79 84.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.239 0.615 . . . . 0.0 110.858 177.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -44.75 87.06 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 123.586 0.554 . . . . 0.0 111.336 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 51' ' ' ILE . 38.9 t -62.1 -49.3 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.866 177.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 m -54.55 -45.84 73.52 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.136 0.974 . . . . 0.0 111.762 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -71.49 -34.19 69.92 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.124 -175.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.508 HD11 HD11 ' A' ' 34' ' ' ILE . 62.8 mt -72.77 -45.52 58.19 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 175.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.1 p . . . . . 0 N--CA 1.477 0.909 0 C-N-CA 123.481 0.713 . . . . 0.0 112.012 -178.364 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -26.87 61.57 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.757 -178.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -64.68 -44.59 89.86 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.496 0.318 . . . . 0.0 110.323 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.39 91.45 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.665 0.603 . . . . 0.0 111.211 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.22 75.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.761 0.824 . . . . 0.0 111.965 -177.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 43.9 mm -68.39 -38.97 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 110.764 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.27 97.27 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.962 0.505 . . . . 0.0 111.187 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.82 -45.8 87.97 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.605 176.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.7 t -66.37 -26.9 67.48 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.044 0.937 . . . . 0.0 111.798 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 123.299 0.64 . . . . 0.0 109.799 -177.055 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.4 ptt? . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.557 ' HG ' HD21 ' A' ' 25' ' ' LEU . 2.1 pt? -59.15 -41.71 88.97 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.2 0.6 . . . . 0.0 112.178 177.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.557 HD21 ' HG ' ' A' ' 24' ' ' LEU . 2.7 mm? -72.78 -44.91 60.98 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.104 0.161 . . . . 0.0 110.657 177.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -59.27 -51.12 71.31 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 124.071 0.857 . . . . 0.0 111.124 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -66.37 -46.98 74.85 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.11 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.472 HD21 ' CD2' ' A' ' 44' ' ' LEU . 19.0 tp -56.19 -49.99 72.5 Favored 'General case' 0 C--N 1.368 1.382 0 O-C-N 123.647 0.592 . . . . 0.0 110.428 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.42 ' NH2' HE22 ' A' ' 35' ' ' GLN . 66.1 ttt180 -54.43 -40.44 68.33 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.797 1.239 . . . . 0.0 111.546 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.89 -46.74 73.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.917 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 pt -93.38 1.59 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -170.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 HD12 ' A' ' 58' ' ' LEU . 68.6 p -117.83 -41.11 2.94 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.089 0.556 . . . . 0.0 110.363 171.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.85 2.47 55.12 Favored Glycine 0 N--CA 1.469 0.89 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.006 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.615 HD12 HD11 ' A' ' 58' ' ' LEU . 67.6 mt -82.15 115.55 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 110.937 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.42 HE22 ' NH2' ' A' ' 29' ' ' ARG . 16.6 mm100 -79.65 -20.52 46.52 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.665 1.186 . . . . 0.0 111.793 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.99 108.02 3.26 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 123.517 0.727 . . . . 0.0 109.823 176.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.0 -27.2 50.45 Favored 'Trans proline' 0 C--N 1.385 2.46 0 C-N-CA 122.603 2.202 . . . . 0.0 111.137 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -58.05 -51.23 70.54 Favored 'General case' 0 C--N 1.352 0.717 0 C-N-CA 124.12 0.968 . . . . 0.0 111.19 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.463 ' CD2' HD11 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -62.49 -28.9 70.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.112 0.965 . . . . 0.0 110.664 -179.058 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.1 mt -73.2 -54.82 7.49 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.623 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -57.55 -38.09 74.17 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.397 0.679 . . . . 0.0 111.55 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -69.03 -37.04 78.38 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.535 0.734 . . . . 0.0 111.829 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.411 ' HB1' HD21 ' A' ' 58' ' ' LEU . . . -62.5 -47.77 82.49 Favored 'General case' 0 C--O 1.241 0.608 0 O-C-N 123.366 0.416 . . . . 0.0 110.868 172.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.1 mm? -64.67 -35.6 81.56 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.563 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -75.43 -36.53 60.77 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.89 -33.82 74.4 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.463 0.705 . . . . 0.0 110.616 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 m -91.1 3.14 55.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.295 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 65.55 12.05 7.91 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.141 1.377 . . . . 0.0 113.099 173.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.4 -11.56 7.16 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 119.518 -0.601 . . . . 0.0 112.624 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -79.64 108.24 13.02 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 117.401 0.601 . . . . 0.0 109.999 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.494 ' O ' HG22 ' A' ' 55' ' ' VAL . 16.2 tt -67.85 -31.34 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.969 -175.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 23.9 m -70.97 -43.39 68.18 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.039 0.536 . . . . 0.0 110.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -68.04 -32.05 72.14 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.207 175.32 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.96 93.78 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.386 0.675 . . . . 0.0 110.978 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 51' ' ' ILE . 40.0 t -60.81 -46.4 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 123.69 0.619 . . . . 0.0 109.698 174.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.6 m -55.82 -39.18 71.02 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.567 0.747 . . . . 0.0 112.158 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.75 -40.28 63.61 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.326 0.651 . . . . 0.0 111.741 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.615 HD11 HD12 ' A' ' 34' ' ' ILE . 88.6 mt -68.69 -46.29 69.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.528 0.331 . . . . 0.0 111.878 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.6 p . . . . . 0 N--CA 1.474 0.745 0 O-C-N 124.096 0.873 . . . . 0.0 111.198 -178.449 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 N--CA 1.488 1.464 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.54 -33.18 73.65 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.231 0.332 . . . . 0.0 110.337 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -72.16 -29.54 64.13 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.642 0.777 . . . . 0.0 111.284 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.15 -44.83 59.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.799 0.84 . . . . 0.0 109.474 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.89 73.19 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.609 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.8 mm -71.04 -40.35 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.457 0.703 . . . . 0.0 111.193 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.01 96.35 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.387 0.429 . . . . 0.0 110.617 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.36 -50.48 67.54 Favored 'General case' 0 C--N 1.353 0.745 0 O-C-N 123.815 0.697 . . . . 0.0 109.71 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -63.8 -29.85 71.0 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.556 0.742 . . . . 0.0 111.211 -178.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.9 tp . . . . . 0 N--CA 1.481 1.123 0 C-N-CA 123.934 0.894 . . . . 0.0 110.561 177.739 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.414 HD11 ' HG ' ' A' ' 44' ' ' LEU . 1.8 pt? -51.83 -44.95 63.78 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.685 0.794 . . . . 0.0 111.85 175.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.43 -38.63 81.37 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.019 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.37 -53.72 44.25 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 123.634 0.584 . . . . 0.0 110.376 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -50.04 -56.46 10.67 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 124.516 1.135 . . . . 0.0 109.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.554 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.4 tp -57.7 -50.16 74.12 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 124.799 1.312 . . . . 0.0 111.166 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -57.26 -39.24 75.2 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.655 1.182 . . . . 0.0 112.489 -175.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.43 -37.02 52.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.303 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 pt -90.11 -14.11 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 80.2 p -102.96 -31.18 10.36 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.288 0.635 . . . . 0.0 110.409 173.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.11 -7.43 76.17 Favored Glycine 0 N--CA 1.47 0.917 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.963 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.471 HD11 HD11 ' A' ' 58' ' ' LEU . 84.6 mt -80.04 117.35 25.72 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 C-N-CA 124.004 0.921 . . . . 0.0 110.993 -173.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -82.35 -25.82 33.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.749 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.426 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 6.7 m-20 -58.92 109.35 1.81 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 124.081 0.952 . . . . 0.0 111.13 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.84 -23.13 48.22 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.113 2.542 . . . . 0.0 111.977 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.2 m -56.91 -52.13 66.39 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.971 0.908 . . . . 0.0 109.933 174.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.35 -38.51 91.45 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.784 0.834 . . . . 0.0 110.897 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.554 ' HA ' HD23 ' A' ' 28' ' ' LEU . 73.8 mt -69.63 -55.49 9.9 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.261 0.976 . . . . 0.0 111.437 -173.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -63.96 -42.41 97.29 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.252 0.621 . . . . 0.0 111.769 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.49 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 45.2 mt-10 -72.52 -29.41 63.57 Favored 'General case' 0 C--N 1.351 0.647 0 C-N-CA 122.876 0.47 . . . . 0.0 111.881 -176.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.15 74.7 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 117.838 0.29 . . . . 0.0 110.407 172.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.437 ' CD2' HD21 ' A' ' 28' ' ' LEU . 3.0 mm? -67.79 -32.72 73.48 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.794 0.838 . . . . 0.0 110.891 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.2 tmmm? -71.53 -44.9 63.77 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.921 0.888 . . . . 0.0 110.238 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.57 -30.47 67.18 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.729 0.812 . . . . 0.0 111.447 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.3 p -85.68 0.48 52.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.448 0.699 . . . . 0.0 112.135 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 64.5 25.75 13.3 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 122.08 0.943 . . . . 0.0 110.491 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.1 65.12 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.456 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -74.58 108.51 7.38 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.542 ' O ' HG21 ' A' ' 55' ' ' VAL . 7.0 tp -55.73 -44.68 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.478 0.486 . . . . 0.0 111.784 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.5 m -66.28 -39.37 89.35 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.842 0.857 . . . . 0.0 111.329 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.478 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 mm-40 -62.9 -43.32 99.12 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 122.976 0.51 . . . . 0.0 110.029 173.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.57 -41.08 93.88 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 124.082 0.864 . . . . 0.0 111.614 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.542 HG21 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -58.86 -49.86 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.299 173.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.1 t -61.75 -31.29 71.46 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.077 0.861 . . . . 0.0 111.788 -178.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.8 mt -73.24 -33.93 65.59 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.471 HD11 HD11 ' A' ' 34' ' ' ILE . 80.2 mt -89.3 -17.54 28.75 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.4 p . . . . . 0 N--CA 1.482 1.165 0 CA-C-N 118.046 0.384 . . . . 0.0 111.867 -178.09 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.836 0.351 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.415 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -59.9 -30.8 69.27 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.181 176.836 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -67.85 -45.17 75.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.135 0.974 . . . . 0.0 110.852 -176.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.45 -27.02 61.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.564 0.746 . . . . 0.0 110.903 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.03 81.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.434 0.694 . . . . 0.0 111.233 174.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 102' ' ' LEU . 42.5 mm -64.53 -42.06 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.953 0.901 . . . . 0.0 109.793 175.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.74 91.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.935 0.894 . . . . 0.0 111.383 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.08 -44.56 84.11 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.7 0.8 . . . . 0.0 109.378 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t -66.49 -36.44 82.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.516 0.726 . . . . 0.0 112.193 -175.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 48.9 mt . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -171.978 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.37 0.129 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.611 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -61.54 -40.93 96.44 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.345 1.058 . . . . 0.0 112.134 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.611 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -64.5 -51.38 63.25 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.929 0.892 . . . . 0.0 110.799 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -69.34 -44.09 72.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.294 1.038 . . . . 0.0 111.456 -172.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -64.64 -46.79 81.03 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.755 0.66 . . . . 0.0 110.949 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -61.39 -46.04 91.85 Favored 'General case' 0 C--N 1.363 1.188 0 O-C-N 123.552 0.533 . . . . 0.0 110.532 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -58.34 -36.95 74.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.782 0.833 . . . . 0.0 111.634 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.86 -45.54 64.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.015 0.526 . . . . 0.0 111.052 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.3 pt -83.22 -19.84 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.488 HG22 HD13 ' A' ' 58' ' ' LEU . 81.4 p -98.91 -40.73 7.94 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.267 0.627 . . . . 0.0 110.142 176.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.49 -3.23 57.74 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.131 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.695 HD13 HD12 ' A' ' 58' ' ' LEU . 61.6 mt -77.74 113.99 17.66 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 C-N-CA 123.588 0.755 . . . . 0.0 111.012 -172.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -81.26 -15.72 54.73 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.706 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.25 114.13 37.43 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.91 -15.86 29.45 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.776 2.317 . . . . 0.0 113.221 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -67.17 -51.02 58.81 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -55.63 -34.74 65.18 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 124.031 0.832 . . . . 0.0 111.881 176.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.2 mt -68.35 -53.81 21.53 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 123.911 0.757 . . . . 0.0 110.428 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -58.8 -38.26 78.19 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.757 175.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -74.97 -29.29 60.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.027 0.531 . . . . 0.0 111.806 -176.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.3 77.43 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' HD13 ' A' ' 24' ' ' LEU . 4.3 mm? -76.42 -23.32 53.98 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.929 0.892 . . . . 0.0 110.073 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -70.45 -56.36 6.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.899 1.28 . . . . 0.0 110.44 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.71 69.36 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.974 0.91 . . . . 0.0 111.061 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.471 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 89.4 p -84.43 -5.75 59.31 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.516 0.726 . . . . 0.0 112.052 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 70.1 13.32 7.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.1 1.36 . . . . 0.0 112.025 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.08 42.84 1.59 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -132.4 115.52 15.68 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.501 0.72 . . . . 0.0 109.352 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.3 tt -74.13 -21.1 17.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.327 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 83.7 m -73.06 -49.81 26.51 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.221 0.608 . . . . 0.0 110.435 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.471 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 29.0 mm-40 -60.19 -40.38 89.82 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.785 172.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.82 -52.99 63.38 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.238 0.961 . . . . 0.0 112.263 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.457 HG21 HG21 ' A' ' 32' ' ' THR . 10.1 p -64.48 -36.0 76.04 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 C-N-CA 122.6 0.36 . . . . 0.0 110.446 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.7 t -63.03 -40.97 99.32 Favored 'General case' 0 CA--C 1.554 1.135 0 O-C-N 123.751 0.657 . . . . 0.0 111.27 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.56 -22.58 54.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.668 0.787 . . . . 0.0 111.648 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.695 HD12 HD13 ' A' ' 34' ' ' ILE . 82.5 mt -85.66 -29.21 24.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.529 0.331 . . . . 0.0 111.545 173.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.0 p . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 122.5 0.32 . . . . 0.0 111.019 174.504 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.4 t70 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.748 0.309 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -23.58 61.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.503 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -63.19 -49.24 75.03 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 172.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.75 -38.09 85.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.652 0.595 . . . . 0.0 111.414 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.64 -49.37 68.91 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.79 0.836 . . . . 0.0 111.436 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.4 mm -67.48 -43.41 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.309 0.643 . . . . 0.0 110.467 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.37 76.9 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 123.949 0.781 . . . . 0.0 111.143 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.38 -43.47 90.62 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.033 0.933 . . . . 0.0 109.604 -178.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.8 t -76.68 -14.08 59.99 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.115 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 tt . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 172.804 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.8 tpp . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.652 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.8 pt? -59.3 -36.88 76.4 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.772 0.829 . . . . 0.0 112.718 -177.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.652 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -66.55 -46.93 74.47 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.123 0.569 . . . . 0.0 110.333 177.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -65.75 -42.55 90.78 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.251 0.97 . . . . 0.0 110.882 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -64.51 -52.58 57.07 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 124.328 1.018 . . . . 0.0 111.001 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.561 HD22 ' HA ' ' A' ' 40' ' ' LEU . 22.2 tp -57.41 -46.97 82.92 Favored 'General case' 0 C--N 1.364 1.227 0 O-C-N 124.065 0.853 . . . . 0.0 110.264 178.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -53.96 -39.72 66.21 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.573 1.149 . . . . 0.0 111.769 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -72.55 -40.43 66.68 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.635 -176.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.0 pt -98.88 2.17 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 123.672 0.789 . . . . 0.0 112.584 -172.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.1 p -112.57 -42.49 3.64 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.307 0.643 . . . . 0.0 109.454 168.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.57 -13.87 38.97 Favored Glycine 0 N--CA 1.468 0.781 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.613 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.487 HD12 HD12 ' A' ' 58' ' ' LEU . 72.0 mt -75.16 110.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.35 0.602 0 C-N-CA 123.912 0.885 . . . . 0.0 110.332 -175.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -71.44 -32.73 68.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.057 0.943 . . . . 0.0 111.17 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -64.11 115.53 20.15 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 123.653 0.781 . . . . 0.0 111.53 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.483 ' HA ' HD12 ' A' ' 40' ' ' LEU . 42.2 Cg_endo -62.59 -22.62 74.19 Favored 'Trans proline' 0 C--N 1.391 2.812 0 C-N-CA 123.579 2.853 . . . . 0.0 112.97 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -54.43 -53.68 50.96 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.884 0.874 . . . . 0.0 110.976 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.89 -33.53 75.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.677 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.561 ' HA ' HD22 ' A' ' 28' ' ' LEU . 46.2 mt -72.28 -47.1 52.67 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 124.428 1.08 . . . . 0.0 111.038 -171.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -60.94 -54.42 45.28 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.709 0.63 . . . . 0.0 109.901 172.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.83 -30.15 68.75 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.876 0.735 . . . . 0.0 112.391 -174.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.34 -49.83 45.29 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 122.971 0.509 . . . . 0.0 110.317 174.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' HD13 ' A' ' 24' ' ' LEU . 3.4 mm? -59.04 -29.74 67.51 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.996 0.918 . . . . 0.0 111.246 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -71.65 -51.0 25.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.401 0.68 . . . . 0.0 109.794 174.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.73 62.59 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.713 0.805 . . . . 0.0 112.434 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -104.4 4.27 33.18 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.551 0.74 . . . . 0.0 112.374 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.6 t30 70.66 -2.63 2.18 Favored 'General case' 0 CA--C 1.571 1.751 0 C-N-CA 124.579 1.152 . . . . 0.0 111.582 -176.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.18 -6.95 10.79 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.777 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -79.28 105.95 10.97 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.006 0.523 . . . . 0.0 110.201 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.462 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.2 tt -65.24 -27.21 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 C-N-CA 122.914 0.485 . . . . 0.0 112.167 -173.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 36.3 m -66.01 -47.39 74.63 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 123.496 0.719 . . . . 0.0 110.685 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.409 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 21.1 mm-40 -60.9 -39.26 88.67 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.604 174.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.34 -41.54 89.42 Favored 'General case' 0 C--O 1.246 0.869 0 O-C-N 124.051 0.845 . . . . 0.0 111.856 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.3 t -59.18 -50.09 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 123.723 0.64 . . . . 0.0 109.71 173.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m -56.7 -41.74 77.91 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 124.307 1.004 . . . . 0.0 111.482 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -74.1 -29.85 62.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.684 0.794 . . . . 0.0 111.898 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.487 HD12 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -84.17 -32.53 24.55 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 177.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.7 p . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -173.833 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -22.91 53.6 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -61.1 -55.98 26.2 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 170.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.14 79.75 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.635 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.57 -56.17 8.08 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.398 0.679 . . . . 0.0 111.414 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.7 mm -64.22 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.226 0.61 . . . . 0.0 110.369 -178.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.25 -47.18 80.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.307 0.643 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.9 tp -65.82 -31.57 72.6 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 122.702 0.401 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.3 t -71.62 -33.61 69.11 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.548 0.739 . . . . 0.0 110.864 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 41.6 tp . . . . . 0 N--CA 1.477 0.901 0 C-N-CA 123.903 0.881 . . . . 0.0 111.022 -178.598 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.486 1.364 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.43 HD13 ' HG ' ' A' ' 44' ' ' LEU . 2.3 pt? -64.55 -39.57 94.0 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.481 0.713 . . . . 0.0 111.578 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.95 -48.16 69.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.688 0.795 . . . . 0.0 110.161 175.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -62.09 -49.9 74.08 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.618 1.199 . . . . 0.0 110.978 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.42 ' O ' HG12 ' A' ' 31' ' ' ILE . 7.9 mm100 -62.45 -56.33 19.2 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.462 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.478 HD23 HD21 ' A' ' 44' ' ' LEU . 20.5 tp -57.56 -45.26 85.37 Favored 'General case' 0 C--N 1.36 1.061 0 O-C-N 123.784 0.677 . . . . 0.0 110.685 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -55.6 -45.28 77.47 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.77 0.828 . . . . 0.0 111.243 176.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.25 -34.96 79.18 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.296 0.638 . . . . 0.0 111.29 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.8 pt -104.8 2.42 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -173.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.1 p -112.33 -50.48 2.9 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.511 0.672 . . . . 0.0 109.668 167.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.49 22.53 10.31 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.927 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.424 HD12 HD13 ' A' ' 58' ' ' LEU . 62.4 mt -101.59 122.76 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.242 0.617 . . . . 0.0 110.28 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -81.59 -26.45 34.91 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.174 0.99 . . . . 0.0 111.91 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.13 112.54 10.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.082 0.553 . . . . 0.0 110.525 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.89 -22.01 49.49 Favored 'Trans proline' 0 C--N 1.385 2.456 0 C-N-CA 122.906 2.404 . . . . 0.0 111.872 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -57.28 -52.25 66.1 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.233 0.958 . . . . 0.0 110.188 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -60.72 -40.84 93.79 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.193 0.933 . . . . 0.0 111.584 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.457 ' HA ' HD22 ' A' ' 28' ' ' LEU . 66.0 mt -68.15 -46.28 71.23 Favored 'General case' 0 C--O 1.246 0.887 0 O-C-N 124.083 0.864 . . . . 0.0 111.488 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 71.2 m-70 -64.96 -51.16 63.31 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.328 176.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -58.0 -33.08 68.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.285 0.634 . . . . 0.0 112.18 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.11 -48.88 61.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 123.747 0.654 . . . . 0.0 110.419 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.478 HD21 HD23 ' A' ' 28' ' ' LEU . 3.3 mm? -61.1 -29.64 69.88 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.903 0.881 . . . . 0.0 111.385 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -76.27 -48.19 21.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.793 0.837 . . . . 0.0 110.704 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.89 -35.3 80.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.784 0.834 . . . . 0.0 111.094 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.0 m -87.77 1.92 52.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.649 0.78 . . . . 0.0 111.571 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.433 HD21 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER 66.44 12.16 8.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.848 1.259 . . . . 0.0 112.6 174.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.57 -11.87 11.15 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-O 119.805 -0.442 . . . . 0.0 112.865 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -77.97 104.88 8.81 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 121.293 0.568 . . . . 0.0 110.483 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.492 ' O ' HG21 ' A' ' 55' ' ' VAL . 18.0 tt -64.04 -26.17 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.014 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.3 m -65.13 -52.77 53.26 Favored 'General case' 0 C--O 1.251 1.179 0 C-N-CA 123.685 0.794 . . . . 0.0 110.908 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.465 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 14.3 mm100 -62.15 -37.93 87.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.815 174.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.72 -44.36 81.53 Favored 'General case' 0 C--O 1.247 0.948 0 O-C-N 124.114 0.884 . . . . 0.0 111.848 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.492 HG21 ' O ' ' A' ' 51' ' ' ILE . 59.6 t -59.31 -50.36 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 122.918 0.487 . . . . 0.0 109.806 172.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m -56.99 -35.75 69.56 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.333 1.021 . . . . 0.0 112.169 -175.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 76.7 mt -72.89 -44.02 61.78 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.939 0.495 . . . . 0.0 110.395 178.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.424 HD13 HD12 ' A' ' 34' ' ' ILE . 58.6 mt -78.03 -10.15 59.47 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.4 p . . . . . 0 N--CA 1.473 0.711 0 C-N-CA 122.86 0.464 . . . . 0.0 110.825 175.993 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.39 -32.35 68.35 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.463 0.705 . . . . 0.0 110.381 -178.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -66.71 -44.64 81.11 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.97 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.22 -35.17 79.03 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 124.104 0.878 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.39 8.37 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.675 0.79 . . . . 0.0 111.073 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.0 mm -61.6 -46.06 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.112 0.965 . . . . 0.0 110.966 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.32 82.31 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.131 0.895 . . . . 0.0 111.149 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -49.44 77.79 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.746 0.654 . . . . 0.0 109.432 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 45.2 m -59.38 -38.24 79.98 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.964 0.79 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.0 mt . . . . . 0 CA--C 1.547 0.856 0 C-N-CA 123.531 0.733 . . . . 0.0 111.812 -179.255 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.5 ttm . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.481 ' HG ' HD21 ' A' ' 25' ' ' LEU . 2.2 pt? -51.57 -41.28 61.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.035 0.934 . . . . 0.0 112.605 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.481 HD21 ' HG ' ' A' ' 24' ' ' LEU . 4.5 mm? -62.99 -52.36 63.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.679 0.792 . . . . 0.0 109.961 176.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -67.37 -39.97 85.72 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 124.218 0.949 . . . . 0.0 111.723 -172.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.447 ' O ' HG12 ' A' ' 31' ' ' ILE . 18.7 mm100 -65.52 -50.42 65.32 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.488 0.715 . . . . 0.0 110.218 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.536 HD22 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -61.55 -45.09 95.65 Favored 'General case' 0 C--N 1.357 0.919 0 O-C-N 123.878 0.737 . . . . 0.0 110.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -56.77 -37.78 71.55 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.595 1.158 . . . . 0.0 111.746 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.59 -51.08 64.59 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.893 0.877 . . . . 0.0 110.496 177.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 27' ' ' GLN . 5.8 pt -96.48 2.38 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -169.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.445 HG23 HD13 ' A' ' 58' ' ' LEU . 73.1 p -110.55 -37.97 5.32 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 167.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.4 -9.07 58.99 Favored Glycine 0 C--N 1.342 0.913 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.012 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.564 HD11 HD12 ' A' ' 58' ' ' LEU . 64.9 mt -79.58 112.17 17.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.491 0 C-N-CA 123.641 0.776 . . . . 0.0 110.409 -174.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -73.11 -29.21 62.75 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.717 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 20.0 t70 -63.09 115.33 16.76 Favored Pre-proline 0 C--N 1.35 0.611 0 C-N-CA 124.0 0.92 . . . . 0.0 111.094 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.442 ' HA ' HD11 ' A' ' 40' ' ' LEU . 58.2 Cg_endo -67.89 -25.92 38.48 Favored 'Trans proline' 0 C--N 1.381 2.287 0 C-N-CA 122.85 2.367 . . . . 0.0 112.744 -176.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.9 m -63.34 -46.6 85.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.677 0.791 . . . . 0.0 111.38 -175.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -61.07 -34.56 75.09 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.576 0.75 . . . . 0.0 111.511 174.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.536 ' HA ' HD22 ' A' ' 28' ' ' LEU . 44.6 mt -70.96 -42.06 70.27 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.856 0.723 . . . . 0.0 110.874 -177.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -66.68 -48.08 70.43 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.934 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.03 -27.33 65.57 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.233 0.333 . . . . 0.0 111.497 -177.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.09 -37.37 69.58 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.629 0.371 . . . . 0.0 110.441 172.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.46 HD23 HD23 ' A' ' 28' ' ' LEU . 1.8 mm? -73.13 -23.96 60.54 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.727 0.811 . . . . 0.0 109.501 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -74.37 -51.68 14.36 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.804 1.241 . . . . 0.0 110.3 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.13 -16.52 63.67 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.817 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.462 ' HG ' ' HB2' ' A' ' 54' ' ' ALA . 92.6 p -101.2 -7.19 23.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.303 0.641 . . . . 0.0 111.76 176.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 64.54 22.62 12.71 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.532 1.133 . . . . 0.0 111.583 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.76 -7.54 31.64 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.933 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.52 112.21 14.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.018 0.527 . . . . 0.0 109.718 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.562 ' O ' HG21 ' A' ' 55' ' ' VAL . 9.3 tp -59.72 -42.08 87.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.997 -175.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.8 m -64.02 -46.43 84.52 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 124.07 0.948 . . . . 0.0 111.206 -173.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -63.14 -42.98 99.58 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.767 176.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.462 ' HB2' ' HG ' ' A' ' 47' ' ' SER . . . -57.35 -42.62 82.37 Favored 'General case' 0 C--O 1.247 0.949 0 O-C-N 123.906 0.754 . . . . 0.0 111.512 178.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.562 HG21 ' O ' ' A' ' 51' ' ' ILE . 47.0 t -60.17 -49.35 84.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.308 0.643 . . . . 0.0 109.773 175.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.4 t -62.59 -35.47 79.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.857 0.723 . . . . 0.0 112.025 -177.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.59 -27.0 55.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.565 0.746 . . . . 0.0 111.539 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.564 HD12 HD11 ' A' ' 34' ' ' ILE . 72.1 mt -86.85 -38.94 16.32 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 173.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 77.5 p . . . . . 0 N--CA 1.487 1.408 0 C-N-CA 123.292 0.637 . . . . 0.0 110.896 178.582 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 C--O 1.247 0.925 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.413 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -76.36 -33.07 58.94 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 119.156 -0.45 . . . . 0.0 112.045 -173.446 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -59.73 -41.51 91.09 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.198 0.454 . . . . 0.0 109.91 174.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.99 -46.33 78.4 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.291 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.49 96.39 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.312 1.008 . . . . 0.0 112.345 -177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 102' ' ' LEU . 49.0 mm -72.48 -45.27 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.443 0.697 . . . . 0.0 110.688 -176.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -28.13 65.71 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.949 0.5 . . . . 0.0 111.289 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 33.2 tp -71.01 -46.09 62.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.212 0.605 . . . . 0.0 109.39 175.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -58.38 -36.03 72.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.768 0.667 . . . . 0.0 110.813 175.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 110.115 179.114 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.637 ' HG ' HD21 ' A' ' 25' ' ' LEU . 2.2 pt? -57.42 -35.44 70.08 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.174 0.989 . . . . 0.0 112.718 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.637 HD21 ' HG ' ' A' ' 24' ' ' LEU . 3.9 mm? -68.83 -46.48 68.46 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -69.55 -39.01 77.7 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.292 0.995 . . . . 0.0 110.529 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.26 -53.21 58.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.304 1.042 . . . . 0.0 110.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -58.15 -47.92 81.86 Favored 'General case' 0 C--N 1.36 1.043 0 O-C-N 123.862 0.726 . . . . 0.0 110.349 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -53.02 -42.23 65.48 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.764 1.225 . . . . 0.0 111.404 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.66 -46.47 79.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.041 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.5 pt -96.02 2.33 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 113.512 0.931 . . . . 0.0 113.512 -171.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.51 HG23 HD11 ' A' ' 58' ' ' LEU . 69.1 p -110.0 -41.78 4.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.049 0.54 . . . . 0.0 109.831 169.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.61 7.18 59.2 Favored Glycine 0 C--N 1.343 0.949 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.678 -176.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.522 HD12 HD13 ' A' ' 58' ' ' LEU . 79.0 mt -95.74 110.08 23.72 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 C-N-CA 124.053 0.941 . . . . 0.0 109.306 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -77.5 -17.74 57.7 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.9 0.88 . . . . 0.0 111.107 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.422 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 3.0 m-20 -65.19 108.08 1.84 Allowed Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 124.997 1.319 . . . . 0.0 110.011 -177.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.28 -26.75 35.28 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 123.114 2.543 . . . . 0.0 112.384 -171.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.7 t -62.39 -47.83 82.43 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.025 0.53 . . . . 0.0 109.858 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -57.89 -36.15 72.01 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.07 0.856 . . . . 0.0 111.492 176.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 mt -71.22 -51.12 26.47 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 123.972 0.795 . . . . 0.0 111.216 -174.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -60.62 -42.35 96.68 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.237 0.615 . . . . 0.0 111.585 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.477 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 40.4 mt-10 -65.99 -35.59 80.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.119 0.568 . . . . 0.0 112.144 -179.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -44.77 66.43 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 123.536 0.523 . . . . 0.0 110.572 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.552 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.7 mm? -61.67 -35.55 78.29 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 124.187 0.929 . . . . 0.0 110.172 176.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.7 tmmm? -68.38 -45.29 73.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.843 0.857 . . . . 0.0 110.174 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.95 -17.97 63.34 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.789 0.836 . . . . 0.0 112.018 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 77.4 p -103.72 0.76 30.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.735 0.814 . . . . 0.0 111.507 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.0 m120 65.0 14.69 9.52 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.963 1.305 . . . . 0.0 112.435 -178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.59 12.46 Favored Glycine 0 C--N 1.353 1.472 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.873 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -79.14 99.26 6.89 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 117.571 0.685 . . . . 0.0 109.521 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 55' ' ' VAL . 17.5 tt -61.05 -29.29 45.4 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.306 0.642 . . . . 0.0 112.518 -172.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 26.8 m -64.78 -47.73 77.06 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.896 0.478 . . . . 0.0 110.608 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -63.37 -35.67 81.16 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.562 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.78 89.22 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.118 0.886 . . . . 0.0 111.274 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 51' ' ' ILE . 41.1 t -59.0 -51.84 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.466 174.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.7 t -57.71 -39.66 77.75 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.949 1.405 . . . . 0.0 111.195 -175.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.72 -29.94 61.35 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.139 0.576 . . . . 0.0 111.808 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.522 HD13 HD12 ' A' ' 34' ' ' ILE . 72.5 mt -76.26 -38.08 56.73 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 123.239 0.337 . . . . 0.0 111.821 173.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.239 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.238 0.466 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -20.89 63.12 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.028 0.531 . . . . 0.0 111.579 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -54.79 42.47 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 171.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -28.93 65.46 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.407 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.15 -50.9 43.6 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.453 0.701 . . . . 0.0 111.381 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.18 -41.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.422 0.689 . . . . 0.0 109.943 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.14 74.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.269 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.6 tp -68.54 -41.01 80.47 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.482 0.713 . . . . 0.0 111.542 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -65.56 -41.44 92.95 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.975 0.51 . . . . 0.0 111.367 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 CA--C 1.546 0.812 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.898 178.877 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.6 ptt? . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.583 ' HG ' HD23 ' A' ' 25' ' ' LEU . 1.8 pt? -63.91 -36.13 82.93 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.633 1.173 . . . . 0.0 111.923 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.583 HD23 ' HG ' ' A' ' 24' ' ' LEU . 3.8 mm? -63.85 -45.66 88.53 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.246 0.618 . . . . 0.0 110.247 176.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -74.12 -37.23 64.15 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.064 0.853 . . . . 0.0 110.983 -172.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -59.98 -52.48 65.2 Favored 'General case' 0 C--N 1.356 0.852 0 O-C-N 124.008 0.817 . . . . 0.0 109.743 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.475 HD21 ' CD2' ' A' ' 44' ' ' LEU . 13.2 tp -62.0 -45.22 94.58 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.338 1.024 . . . . 0.0 110.954 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -58.3 -39.31 78.99 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.994 0.918 . . . . 0.0 111.583 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.78 -50.78 61.57 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.596 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.0 pt -81.61 -19.77 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.532 HG23 HD11 ' A' ' 58' ' ' LEU . 80.6 p -99.35 -42.77 6.84 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.026 0.53 . . . . 0.0 110.556 178.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.12 -0.05 57.28 Favored Glycine 0 N--CA 1.469 0.849 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.329 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.635 HD12 HD13 ' A' ' 58' ' ' LEU . 95.4 mt -80.42 111.5 17.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.852 0.861 . . . . 0.0 109.524 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -75.04 -34.77 61.9 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.783 0.833 . . . . 0.0 110.527 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -56.51 106.65 0.71 Allowed Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 124.457 1.103 . . . . 0.0 111.241 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' HD13 ' A' ' 40' ' ' LEU . 59.8 Cg_endo -68.45 -21.16 40.9 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 122.897 2.398 . . . . 0.0 112.103 -175.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -66.69 -44.64 81.21 Favored 'General case' 0 C--N 1.349 0.579 0 C-N-CA 123.541 0.736 . . . . 0.0 110.862 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.455 ' HB3' HG21 ' A' ' 34' ' ' ILE . 2.0 t80 -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.285 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 37' ' ' PRO . 47.4 mt -72.21 -42.82 65.32 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.649 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -60.36 -43.13 96.83 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.273 0.629 . . . . 0.0 110.908 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.538 ' HA ' ' HE3' ' A' ' 45' ' ' LYS . 44.3 mt-10 -63.09 -39.03 93.51 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.623 0.769 . . . . 0.0 111.471 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.72 77.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.319 0.648 . . . . 0.0 111.506 174.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.541 ' HG ' HD13 ' A' ' 24' ' ' LEU . 3.5 mm? -66.82 -30.49 70.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.038 0.935 . . . . 0.0 110.753 -179.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.538 ' HE3' ' HA ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -75.1 -40.68 59.79 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.112 0.965 . . . . 0.0 110.108 179.018 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.57 -35.16 80.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.633 0.773 . . . . 0.0 110.365 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 m -91.12 -3.53 57.01 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.473 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 62.59 20.91 12.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.232 1.413 . . . . 0.0 112.607 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 120.93 -5.25 11.36 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 119.426 -0.652 . . . . 0.0 113.483 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -87.17 115.51 24.61 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.443 0.621 . . . . 0.0 111.012 -178.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.0 tp -66.0 -32.28 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 123.916 0.886 . . . . 0.0 111.733 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -66.44 -47.44 73.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.088 0.955 . . . . 0.0 111.786 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -69.13 -38.24 78.75 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 176.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.98 67.63 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 123.794 0.683 . . . . 0.0 111.893 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.53 -39.93 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.86 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -61.97 -31.3 71.63 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.174 0.59 . . . . 0.0 111.854 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.9 mt -83.17 -36.3 24.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.994 0.918 . . . . 0.0 111.518 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.635 HD13 HD12 ' A' ' 34' ' ' ILE . 53.2 mt -73.15 -29.15 62.67 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 177.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 N--CA 1.471 0.624 0 C-N-CA 122.766 0.427 . . . . 0.0 110.063 173.853 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.37 77.5 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.349 0.522 . . . . 0.0 110.65 176.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -61.74 -50.37 72.67 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.797 0.686 . . . . 0.0 109.98 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.19 -31.81 70.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.6 1.187 . . . . 0.0 111.651 -176.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -72.02 -46.57 56.61 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.599 0.76 . . . . 0.0 111.161 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.9 mm -67.66 -39.3 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.419 0.687 . . . . 0.0 109.596 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.39 97.03 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.09 0.956 . . . . 0.0 111.43 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.37 -40.64 85.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 0.0 109.239 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 t -65.55 -41.29 93.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.297 0.639 . . . . 0.0 111.419 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 123.256 0.622 . . . . 0.0 110.181 -177.292 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.539 ' HG ' HD21 ' A' ' 25' ' ' LEU . 2.3 pt? -62.08 -38.25 88.14 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.539 HD21 ' HG ' ' A' ' 24' ' ' LEU . 3.5 mm? -65.58 -46.15 80.54 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 176.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -64.45 -50.14 68.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.944 -174.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.28 71.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 112.047 -177.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.544 HD11 HD12 ' A' ' 58' ' ' LEU . 2.3 tm? -68.34 -38.07 81.15 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.2 -177.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -65.54 -35.65 81.48 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.178 0.591 . . . . 0.0 110.941 172.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.64 -39.12 92.86 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.58 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.2 pt -96.41 -13.97 7.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.7 p -102.43 -51.83 3.25 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.05 0.841 . . . . 0.0 110.89 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.75 7.22 42.31 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.378 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.626 HD12 HD11 ' A' ' 58' ' ' LEU . 60.6 mt -86.81 123.32 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.03 0.532 . . . . 0.0 110.891 -175.219 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -88.66 -11.63 44.74 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.98 0.912 . . . . 0.0 111.932 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.52 111.74 10.57 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-O 118.653 -0.689 . . . . 0.0 109.702 175.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.88 -36.92 81.31 Favored 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.014 2.476 . . . . 0.0 112.256 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.467 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 55.6 m -62.69 -48.9 77.3 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.577 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -52.76 -40.67 63.36 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.232 1.013 . . . . 0.0 112.127 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 27.6 mt -66.26 -47.87 72.32 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 124.2 0.938 . . . . 0.0 109.788 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -61.19 -42.09 97.96 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.218 175.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 38' ' ' SER . 14.1 mm-40 -69.85 -32.98 71.66 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.356 1.063 . . . . 0.0 110.669 -174.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.87 -46.86 70.52 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 123.975 0.797 . . . . 0.0 110.672 175.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.416 ' HG ' HD13 ' A' ' 24' ' ' LEU . 3.6 mm? -64.31 -34.81 78.99 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.878 0.871 . . . . 0.0 109.939 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 4.1 tmmm? -69.98 -42.21 73.42 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.224 1.01 . . . . 0.0 110.244 178.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.63 -22.19 60.07 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.825 0.85 . . . . 0.0 111.358 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -104.38 5.2 34.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.287 0.635 . . . . 0.0 111.642 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 66.31 17.57 10.73 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.228 1.011 . . . . 0.0 111.529 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.49 -3.36 24.9 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.72 178.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -82.59 111.54 18.67 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.555 0.742 . . . . 0.0 110.087 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.431 HG13 HD21 ' A' ' 28' ' ' LEU . 20.6 tt -74.33 -24.6 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 122.742 0.417 . . . . 0.0 111.915 -174.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.7 m -71.66 -44.81 63.63 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.587 0.755 . . . . 0.0 110.535 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.485 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -71.45 -34.66 70.44 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.119 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -51.72 68.34 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.646 0.778 . . . . 0.0 112.242 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.43 -39.28 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 122.581 0.352 . . . . 0.0 110.741 175.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.2 t -59.82 -31.38 69.68 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.012 0.525 . . . . 0.0 111.719 178.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 88.0 mt -78.92 -41.33 29.76 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.207 0.603 . . . . 0.0 111.552 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.626 HD11 HD12 ' A' ' 34' ' ' ILE . 74.1 mt -76.22 -21.06 56.86 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.478 0.945 0 C-N-CA 122.879 0.472 . . . . 0.0 111.741 176.075 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -26.35 67.74 Favored 'General case' 0 C--N 1.349 0.565 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.225 -178.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -63.49 -55.53 23.3 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.43 -38.51 80.86 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.359 0.664 . . . . 0.0 111.751 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.82 -54.44 38.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.492 0.717 . . . . 0.0 111.807 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.16 -44.68 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.824 0.85 . . . . 0.0 110.583 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.53 75.34 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.716 0.806 . . . . 0.0 111.497 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.82 -39.65 83.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.927 0.891 . . . . 0.0 110.228 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -68.07 -44.95 75.17 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.736 0.415 . . . . 0.0 111.148 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt . . . . . 0 N--CA 1.475 0.82 0 C-N-CA 123.049 0.54 . . . . 0.0 111.568 179.757 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 111.421 0.156 . . . . 0.0 111.421 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.485 HD11 ' HG ' ' A' ' 44' ' ' LEU . 2.1 pt? -64.78 -35.14 80.13 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.83 0.852 . . . . 0.0 111.623 177.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.09 -53.24 58.17 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -64.67 -45.54 86.28 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.941 -173.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -61.4 -55.46 31.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.147 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.9 tp -59.76 -47.15 86.81 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 123.472 0.482 . . . . 0.0 110.45 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -53.37 -40.23 64.81 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.694 1.198 . . . . 0.0 111.857 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.76 -46.64 62.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.047 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 pt -89.9 -0.67 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.49 HG22 HD13 ' A' ' 58' ' ' LEU . 74.2 p -108.31 -46.98 3.61 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.682 0.793 . . . . 0.0 109.574 170.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.43 -8.28 40.67 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.467 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.404 HD11 ' HB3' ' A' ' 58' ' ' LEU . 75.0 mt -80.47 117.23 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.115 0.966 . . . . 0.0 110.486 -176.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -83.48 -17.03 43.37 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.224 0.953 . . . . 0.0 111.22 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.72 108.8 2.41 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.116 0.966 . . . . 0.0 109.776 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.74 -30.31 59.35 Favored 'Trans proline' 0 C--N 1.379 2.136 0 C-N-CA 122.725 2.284 . . . . 0.0 112.517 -173.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 57.3 m -58.48 -52.59 64.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.018 0.527 . . . . 0.0 110.433 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -51.68 -35.08 41.2 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.303 1.041 . . . . 0.0 112.046 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.545 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.5 mt -70.96 -45.98 63.18 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 123.802 0.689 . . . . 0.0 110.643 -177.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -66.48 -37.02 84.18 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.712 0.405 . . . . 0.0 111.379 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 38' ' ' SER . 18.5 mm-40 -64.22 -46.21 84.86 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.226 1.01 . . . . 0.0 110.765 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -41.1 96.69 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.63 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.485 ' HG ' HD11 ' A' ' 24' ' ' LEU . 3.3 mm? -69.74 -37.49 76.48 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.387 0.675 . . . . 0.0 111.524 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HZ3' ' HB3' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -74.26 -36.57 63.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.433 0.293 . . . . 0.0 110.521 -176.944 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.64 -22.02 51.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.242 0.617 . . . . 0.0 111.804 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.6 p -94.96 3.13 55.3 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.234 0.614 . . . . 0.0 111.795 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 75.92 -18.7 0.45 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 125.084 1.354 . . . . 0.0 112.004 -175.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 140.05 -7.16 2.91 Favored Glycine 0 C--N 1.343 0.929 0 N-CA-C 111.971 -0.452 . . . . 0.0 111.971 -172.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -78.23 107.27 10.72 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.038 0.535 . . . . 0.0 110.558 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.456 ' O ' HG23 ' A' ' 55' ' ' VAL . 13.3 tt -66.98 -26.63 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.5 m -67.03 -50.22 62.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.397 0.618 . . . . 0.0 110.207 177.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.406 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 16.5 mm100 -61.99 -36.06 80.36 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.612 176.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.75 90.94 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 123.758 0.823 . . . . 0.0 111.7 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -59.97 -45.48 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 173.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -58.71 -35.59 72.9 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.724 0.809 . . . . 0.0 111.756 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.3 mt -71.63 -40.03 70.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.31 0.644 . . . . 0.0 111.034 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.49 HD13 HG22 ' A' ' 32' ' ' THR . 51.9 mt -75.61 -25.15 56.71 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p . . . . . 0 CA--C 1.548 0.881 0 C-N-CA 122.463 0.305 . . . . 0.0 110.441 174.678 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.3 t70 . . . . . 0 CA--C 1.549 0.928 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -29.35 70.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.979 0.512 . . . . 0.0 111.646 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -64.31 -52.71 57.18 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.091 0.556 . . . . 0.0 110.944 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.64 -30.23 68.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.323 0.649 . . . . 0.0 111.498 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.88 -54.69 30.83 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.714 0.806 . . . . 0.0 110.941 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -70.76 -36.78 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.471 0.708 . . . . 0.0 110.773 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.35 -38.91 92.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.828 0.851 . . . . 0.0 111.123 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 52.3 tp -70.94 -41.19 71.48 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.7 m -63.58 -29.58 70.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.851 0.46 . . . . 0.0 111.259 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 56.5 tp . . . . . 0 N--CA 1.472 0.627 0 C-N-CA 124.171 0.989 . . . . 0.0 109.874 179.177 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.518 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.4 pt? -66.26 -39.43 89.46 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.589 0.756 . . . . 0.0 111.12 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.518 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -66.98 -46.94 73.07 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.12 0.568 . . . . 0.0 110.188 177.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -62.16 -52.05 65.4 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.64 1.213 . . . . 0.0 110.968 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -58.42 -53.7 55.4 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.204 0.94 . . . . 0.0 111.043 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.426 HD12 HD21 ' A' ' 40' ' ' LEU . 2.1 tm? -56.24 -50.75 70.41 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.259 0.974 . . . . 0.0 110.027 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.45 ' HB2' HD12 ' A' ' 40' ' ' LEU . 72.4 ttt180 -61.14 -33.73 73.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.117 0.967 . . . . 0.0 111.952 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -74.12 -40.41 62.69 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.568 0.747 . . . . 0.0 110.723 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 pt -95.18 -15.5 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.589 -169.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.9 p -96.36 -43.13 7.8 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.95 -4.69 61.18 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.868 -177.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.48 HD12 HD13 ' A' ' 58' ' ' LEU . 62.5 mt -75.3 120.36 24.81 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 123.756 0.822 . . . . 0.0 109.443 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -86.43 -17.55 34.01 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.57 0.748 . . . . 0.0 111.353 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -70.16 109.48 4.93 Favored Pre-proline 0 N--CA 1.483 1.18 0 C-N-CA 123.544 0.738 . . . . 0.0 110.205 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.6 -25.46 79.3 Favored 'Trans proline' 0 C--N 1.388 2.637 0 C-N-CA 123.217 2.611 . . . . 0.0 113.255 -175.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m -58.36 -51.74 68.54 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.662 0.601 . . . . 0.0 110.555 177.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.15 -36.46 79.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.733 0.813 . . . . 0.0 111.423 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.45 HD12 ' HB2' ' A' ' 29' ' ' ARG . 13.9 mt -68.2 -56.67 7.88 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 124.386 1.054 . . . . 0.0 109.521 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -59.86 -50.19 74.75 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.117 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -56.68 -40.21 75.15 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.568 0.747 . . . . 0.0 111.903 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.8 87.3 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.739 0.65 . . . . 0.0 110.873 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.413 HD21 ' O ' ' A' ' 40' ' ' LEU . 4.3 mm? -69.35 -23.53 63.78 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.825 0.85 . . . . 0.0 111.888 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -47.94 17.87 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.31 86.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 124.228 0.955 . . . . 0.0 110.943 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.9 m -89.58 -3.29 58.37 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.778 0.831 . . . . 0.0 111.908 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.424 HD21 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER 64.2 21.94 12.7 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.69 1.196 . . . . 0.0 112.47 176.256 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.26 -8.56 24.79 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-O 119.675 -0.514 . . . . 0.0 113.218 178.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.06 111.86 13.09 Favored 'General case' 0 C--O 1.246 0.918 0 CA-C-N 117.329 0.564 . . . . 0.0 110.519 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.44 ' O ' HG23 ' A' ' 55' ' ' VAL . 5.7 tp -65.98 -34.46 70.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 C-N-CA 123.268 0.627 . . . . 0.0 111.351 -173.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 35.7 m -66.65 -49.97 64.47 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.823 0.849 . . . . 0.0 110.866 -173.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -64.28 -39.94 94.96 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.259 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.88 -52.89 59.05 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.071 0.857 . . . . 0.0 112.317 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.9 t -63.73 -44.0 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 122.973 0.509 . . . . 0.0 110.433 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 t -58.5 -43.67 89.15 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 124.261 0.976 . . . . 0.0 111.187 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.16 -30.23 62.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.957 -176.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.48 HD13 HD12 ' A' ' 34' ' ' ILE . 72.8 mt -72.33 -40.71 67.21 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.481 1.088 0 C-N-CA 122.868 0.467 . . . . 0.0 111.62 -178.166 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 . . . . . 0 N--CA 1.467 0.391 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -32.1 73.42 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.225 0.61 . . . . 0.0 110.365 175.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -62.82 -56.92 13.15 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.794 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.75 -33.31 75.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 124.095 0.872 . . . . 0.0 111.421 -176.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.05 -59.62 4.24 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.427 0.691 . . . . 0.0 111.517 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.46 -41.19 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.468 0.707 . . . . 0.0 110.776 -176.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.82 -42.55 90.47 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.258 0.623 . . . . 0.0 111.799 -178.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.34 -40.91 77.27 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.6 t -62.55 -43.89 97.69 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.502 0.721 . . . . 0.0 111.332 179.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tt . . . . . 0 N--CA 1.481 1.092 0 C-N-CA 123.788 0.835 . . . . 0.0 109.786 -176.638 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -61.08 -46.44 90.62 Favored 'General case' 0 C--O 1.253 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 111.072 -178.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.502 HD23 ' HB2' ' A' ' 40' ' ' LEU . 44.3 mt -74.32 -42.58 59.23 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.817 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -62.92 -42.48 99.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.056 0.847 . . . . 0.0 111.247 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.472 ' O ' HG12 ' A' ' 31' ' ' ILE . 13.5 mm100 -63.26 -57.99 8.63 Favored 'General case' 0 C--N 1.356 0.851 0 CA-C-O 118.681 -0.676 . . . . 0.0 110.188 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.466 ' HB3' HD22 ' A' ' 40' ' ' LEU . 16.8 mt -51.49 -53.23 39.53 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 123.979 0.799 . . . . 0.0 111.387 176.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -53.14 -38.66 62.9 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.567 1.147 . . . . 0.0 112.162 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.49 -51.66 33.8 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.287 0.635 . . . . 0.0 110.846 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 27' ' ' GLN . 4.6 pt -91.28 4.03 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -172.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.456 HG22 HD11 ' A' ' 58' ' ' LEU . 45.3 p -122.1 -38.62 2.68 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.432 0.693 . . . . 0.0 110.344 175.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.94 -1.68 63.42 Favored Glycine 0 N--CA 1.475 1.287 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.488 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.421 ' HB ' HD23 ' A' ' 40' ' ' LEU . 86.0 mt -79.73 117.31 25.26 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 123.77 0.828 . . . . 0.0 109.922 -178.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -81.97 -18.6 42.9 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.739 0.649 . . . . 0.0 110.694 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 5.5 m-20 -68.77 104.88 0.81 Allowed Pre-proline 0 N--CA 1.481 1.076 0 C-N-CA 123.991 0.916 . . . . 0.0 109.747 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.71 -25.31 34.0 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.648 2.232 . . . . 0.0 111.799 -174.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 42' ' ' GLU . 42.8 m -66.61 -42.58 86.61 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.909 0.884 . . . . 0.0 110.806 177.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -66.08 -38.67 88.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.874 0.87 . . . . 0.0 109.821 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.502 ' HB2' HD23 ' A' ' 25' ' ' LEU . 56.5 mt -64.58 -41.42 96.27 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.604 175.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -62.5 -44.67 95.82 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 38' ' ' SER . 52.4 mt-10 -61.16 -37.87 84.44 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.587 0.555 . . . . 0.0 111.339 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.39 -48.15 62.04 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.786 0.679 . . . . 0.0 110.994 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.444 HD23 HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.38 -40.62 78.55 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.397 1.079 . . . . 0.0 110.35 179.284 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.66 -37.04 59.93 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.295 1.038 . . . . 0.0 111.722 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -15.75 62.88 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.686 0.394 . . . . 0.0 111.547 178.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -106.94 11.27 30.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.853 0.861 . . . . 0.0 110.982 177.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 65.82 15.79 10.2 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.489 1.116 . . . . 0.0 112.827 175.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.15 -0.34 28.31 Favored Glycine 0 C--N 1.341 0.83 0 C-N-CA 123.36 0.505 . . . . 0.0 112.343 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -83.55 110.4 18.19 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 123.182 0.593 . . . . 0.0 111.078 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.564 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.1 tp -56.34 -38.71 56.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.707 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -58.43 -60.02 4.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.75 1.22 . . . . 0.0 112.279 -173.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.429 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 mm100 -66.93 -28.57 68.4 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.286 178.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.42 93.05 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.34 0.4 . . . . 0.0 111.019 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 51' ' ' ILE . 20.5 t -60.09 -46.99 93.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.131 0 O-C-N 123.762 0.664 . . . . 0.0 109.306 175.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.3 t -53.65 -50.41 65.82 Favored 'General case' 0 C--N 1.354 0.8 0 O-C-N 124.609 1.193 . . . . 0.0 111.683 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 89.3 mt -60.47 -44.13 96.22 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.689 0.618 . . . . 0.0 111.336 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.456 HD11 HG22 ' A' ' 32' ' ' THR . 71.6 mt -73.26 -30.88 63.74 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 176.452 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.738 0.304 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -23.23 41.01 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.693 -177.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -59.64 -55.83 29.45 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.64 -31.44 68.37 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.337 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.09 -56.53 21.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.861 0.464 . . . . 0.0 111.134 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.47 -43.35 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.011 0.524 . . . . 0.0 110.776 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.67 68.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.916 0.887 . . . . 0.0 111.639 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.88 -41.19 75.12 Favored 'General case' 0 C--N 1.351 0.646 0 O-C-N 123.758 0.661 . . . . 0.0 111.331 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.8 m -64.61 -31.02 72.05 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 123.369 0.418 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 C-N-CA 123.821 0.848 . . . . 0.0 109.672 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 . . . . . 0 N--CA 1.486 1.33 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 54.7 ttm -54.32 -46.14 72.77 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.292 -167.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.529 HD11 ' HG ' ' A' ' 44' ' ' LEU . 2.6 pt? -63.42 -37.26 86.59 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.474 HD11 ' HB2' ' A' ' 40' ' ' LEU . 3.0 mm? -68.17 -44.48 75.83 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -65.84 -46.87 76.93 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.244 0.965 . . . . 0.0 111.044 -176.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.413 ' O ' HG12 ' A' ' 31' ' ' ILE . 4.6 mm100 -59.63 -56.42 22.12 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 124.699 1.249 . . . . 0.0 110.858 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.477 HD23 ' HA ' ' A' ' 40' ' ' LEU . 18.7 tp -56.98 -48.26 78.83 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 124.095 0.872 . . . . 0.0 110.868 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -55.1 -41.93 72.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.751 0.82 . . . . 0.0 111.434 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.55 -44.05 83.42 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.234 1.014 . . . . 0.0 109.948 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.7 pt -97.66 2.26 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -171.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.513 HG23 HD12 ' A' ' 58' ' ' LEU . 68.0 p -114.11 -49.6 2.85 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 170.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 111.69 -10.59 27.87 Favored Glycine 0 C--N 1.338 0.68 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.784 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.658 HD12 HD11 ' A' ' 58' ' ' LEU . 90.5 mt -71.32 119.86 18.41 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 C-N-CA 123.399 0.68 . . . . 0.0 110.652 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -86.37 -20.63 27.99 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.139 0.976 . . . . 0.0 111.685 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.405 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.8 t70 -70.81 114.46 26.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.194 0.598 . . . . 0.0 110.405 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.08 -30.52 65.83 Favored 'Trans proline' 0 C--N 1.382 2.299 0 C-N-CA 122.735 2.29 . . . . 0.0 113.24 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.5 t -68.66 -43.13 76.87 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.746 0.419 . . . . 0.0 110.114 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.401 ' HB3' HG21 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -60.34 -32.09 70.92 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.524 1.129 . . . . 0.0 110.662 -179.089 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.477 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 mt -70.42 -48.72 54.75 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.587 178.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -55.43 -47.01 76.63 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.838 173.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.33 -28.48 67.19 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.553 0.741 . . . . 0.0 111.932 -173.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.98 -46.68 67.46 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 123.541 0.526 . . . . 0.0 110.831 172.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.529 ' HG ' HD11 ' A' ' 24' ' ' LEU . 4.0 mm? -61.68 -31.54 71.68 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.717 0.807 . . . . 0.0 110.632 175.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -74.52 -38.36 62.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.8 0.84 . . . . 0.0 110.758 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.15 -33.11 69.74 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.62 0.768 . . . . 0.0 111.036 -178.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.1 p -91.03 2.2 56.5 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.936 0.894 . . . . 0.0 111.474 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 66.8 t30 63.21 16.79 9.69 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.657 1.183 . . . . 0.0 111.946 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 125.92 -25.45 5.54 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.395 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -74.86 106.86 6.59 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.306 0.553 . . . . 0.0 110.536 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.443 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.8 tt -68.89 -27.9 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.055 0.542 . . . . 0.0 112.079 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -66.66 -46.33 76.05 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.469 0.707 . . . . 0.0 110.637 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.5 mm-40 -62.52 -37.28 85.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.612 173.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.66 87.87 Favored 'General case' 0 C--O 1.244 0.763 0 C-N-CA 123.523 0.729 . . . . 0.0 111.001 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.1 t -60.8 -51.24 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 123.709 0.631 . . . . 0.0 110.165 174.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -55.04 -39.32 69.02 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 124.386 1.054 . . . . 0.0 111.538 -177.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 91.8 mt -73.4 -37.07 66.07 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.399 -178.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.658 HD11 HD12 ' A' ' 34' ' ' ILE . 50.0 mt -74.11 -33.36 63.56 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 120.55 0.214 . . . . 0.0 111.484 177.14 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.4 p -83.77 8.12 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.096 0.558 . . . . 0.0 111.175 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.516 ' HA ' ' HB ' ' A' ' 63' ' ' VAL . 33.8 t70 -58.36 -23.53 57.16 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.399 0.68 . . . . 0.0 111.174 172.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -55.78 -21.69 20.47 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 123.865 0.866 . . . . 0.0 112.699 172.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.25 2.38 5.76 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.128 0.971 . . . . 0.0 111.757 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.516 ' HB ' ' HA ' ' A' ' 60' ' ' ASP . 73.9 t -105.87 -15.39 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 123.742 0.817 . . . . 0.0 110.416 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.53 -28.91 65.91 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 124.423 1.089 . . . . 0.0 112.917 -176.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.17 132.18 87.49 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 124.625 1.17 . . . . 0.0 111.855 -174.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.38 131.56 20.38 Favored 'Cis proline' 0 C--N 1.388 2.657 0 CA-C-N 120.24 1.122 . . . . 0.0 112.986 3.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.2 p -73.11 -172.74 1.13 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 111.708 -174.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -73.17 -175.44 1.85 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.415 0.686 . . . . 0.0 110.799 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -62.7 92.79 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.279 0.632 . . . . 0.0 111.696 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.4 p -102.23 82.72 2.23 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 168.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.24 111.84 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.068 -170.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.62 71.7 2.54 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.945 0.898 . . . . 0.0 110.53 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.5 m -144.85 115.32 7.63 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.088 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -82.52 124.39 77.81 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.193 0.997 . . . . 0.0 108.927 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.86 124.69 12.94 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.464 2.776 . . . . 0.0 113.447 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.6 m -63.02 117.84 7.01 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.69 0.796 . . . . 0.0 110.64 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -29.04 66.88 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.656 0.783 . . . . 0.0 111.36 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 46.3 t -98.32 108.42 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -112.95 97.65 6.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.595 0.758 . . . . 0.0 109.187 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.17 -26.57 73.42 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.46 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.8 p -74.04 82.68 1.75 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.187 0.995 . . . . 0.0 110.308 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.85 -34.07 26.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.362 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -73.66 97.27 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.506 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -63.45 -27.99 69.67 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.777 0.831 . . . . 0.0 110.744 175.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -71.07 113.24 7.91 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.983 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -105.02 104.77 14.56 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.57 0.748 . . . . 0.0 109.202 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.55 92.48 3.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.9 tp -87.54 92.88 9.25 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -121.64 100.74 7.18 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.418 ' N ' ' HE2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -64.65 160.24 20.24 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.08 0.552 . . . . 0.0 111.974 -177.805 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.2 34.65 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.584 0.706 . . . . 0.0 109.887 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 16.8 mt -90.79 28.52 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 C-N-CA 124.18 0.992 . . . . 0.0 110.248 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -77.44 83.89 3.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.896 0.855 . . . . 0.0 109.969 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -84.23 57.28 4.15 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-O 122.588 1.185 . . . . 0.0 110.227 176.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.0 t -76.16 76.61 2.99 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.336 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -80.0 -34.56 38.41 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 114.286 -1.325 . . . . 0.0 109.274 -177.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.3 p30 42.77 29.09 0.15 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 126.591 1.956 . . . . 0.0 114.649 172.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -65.24 114.45 4.72 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.957 0.503 . . . . 0.0 110.555 -175.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -69.51 155.52 40.34 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 124.184 0.928 . . . . 0.0 110.587 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.27 -15.83 61.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.261 0.624 . . . . 0.0 111.54 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -62.86 -62.02 2.01 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 123.665 0.786 . . . . 0.0 111.457 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -29.04 64.94 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.07 0.395 . . . . 0.0 111.0 -177.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -64.19 -52.68 57.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.025 0.53 . . . . 0.0 110.468 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.01 -23.22 61.36 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.156 0.91 . . . . 0.0 111.4 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.38 -52.98 21.88 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.939 0.496 . . . . 0.0 111.025 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.8 mm -64.01 -43.23 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.718 0.807 . . . . 0.0 109.611 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.74 -41.71 95.91 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.03 0.932 . . . . 0.0 110.911 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 tt -66.16 -44.82 82.99 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.861 0.865 . . . . 0.0 110.213 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -64.39 -34.4 78.08 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.489 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.36 -28.0 38.11 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.203 0.601 . . . . 0.0 110.869 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.76 -34.43 69.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.976 0.51 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.69 12.34 7.37 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.4 t -52.96 119.22 15.7 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.647 0.779 . . . . 0.0 110.335 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.17 158.34 15.15 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 123.132 2.555 . . . . 0.0 114.573 -174.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.451 ' HZ2' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -74.69 -4.77 39.33 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.168 175.256 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 45.9 mm -64.57 109.44 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -100.14 9.41 42.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.161 0.585 . . . . 0.0 111.713 -177.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -157.6 81.99 0.89 Allowed 'General case' 0 C--N 1.351 0.633 0 C-N-CA 122.192 0.197 . . . . 0.0 110.995 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 38.6 t70 65.17 -71.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 125.336 1.454 . . . . 0.0 113.204 169.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -163.64 75.32 0.17 Allowed Glycine 0 C--N 1.347 1.158 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -94.29 23.35 5.19 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.866 0.866 . . . . 0.0 111.921 179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.434 ' HB3' HD22 ' A' ' 123' ' ' LEU . 19.2 t70 -60.19 -40.47 90.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.63 0.772 . . . . 0.0 110.027 173.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.434 HD22 ' HB3' ' A' ' 122' ' ' ASP . 2.7 mm? -86.24 37.13 0.71 Allowed 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.011 -177.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -64.25 128.64 36.69 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 168.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? 64.51 38.6 7.32 Favored 'General case' 0 CA--C 1.559 1.301 0 O-C-N 124.43 1.081 . . . . 0.0 111.032 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.54 164.06 27.04 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.13 173.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -121.59 102.98 8.58 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 173.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.87 -28.12 69.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.413 0.685 . . . . 0.0 112.525 -175.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 67.55 29.98 6.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.801 1.241 . . . . 0.0 112.314 175.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.4 m -75.61 91.53 2.86 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.5 p -77.72 91.07 4.03 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.927 -178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.966 0 C-N-CA 124.379 1.072 . . . . 0.0 109.239 -179.264 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.453 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 13.4 mm100 . . . . . 0 N--CA 1.477 0.901 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.1 tpt -50.02 -43.81 50.94 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.668 0.787 . . . . 0.0 111.661 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.588 ' HG ' HD23 ' A' ' 25' ' ' LEU . 2.5 pt? -70.48 -38.16 74.35 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.659 0.784 . . . . 0.0 111.926 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.588 HD23 ' HG ' ' A' ' 24' ' ' LEU . 4.0 mm? -65.67 -53.19 44.54 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.824 0.449 . . . . 0.0 110.072 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -65.05 -41.41 95.19 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.968 1.418 . . . . 0.0 111.66 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -57.83 -51.49 69.38 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.802 0.441 . . . . 0.0 110.125 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.475 ' HA ' HG12 ' A' ' 31' ' ' ILE . 14.4 tp -63.08 -37.32 86.72 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 123.697 0.623 . . . . 0.0 110.821 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 20.2 ttp180 -63.02 -39.34 94.46 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.147 0.979 . . . . 0.0 110.62 -176.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.56 -20.18 34.27 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.422 -177.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.475 HG12 ' HA ' ' A' ' 28' ' ' LEU . 17.1 pt -99.4 -8.32 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 176.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.488 HG22 HD12 ' A' ' 58' ' ' LEU . 69.2 p -108.54 -48.12 3.38 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.06 0.544 . . . . 0.0 110.675 174.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.84 -16.44 28.24 Favored Glycine 0 N--CA 1.467 0.74 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.81 -175.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.643 HD11 HD11 ' A' ' 58' ' ' LEU . 57.0 mt -72.68 107.23 3.26 Favored 'Isoleucine or valine' 0 C--N 1.357 0.91 0 C-N-CA 124.039 0.935 . . . . 0.0 110.238 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -78.77 -1.69 35.95 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.025 0.93 . . . . 0.0 111.793 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -88.21 104.49 7.09 Favored Pre-proline 0 N--CA 1.474 0.751 0 C-N-CA 123.955 0.902 . . . . 0.0 109.656 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HA ' HD11 ' A' ' 40' ' ' LEU . 37.3 Cg_endo -63.16 -25.42 72.72 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.069 2.513 . . . . 0.0 113.027 -176.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -60.44 -43.7 96.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.591 0.757 . . . . 0.0 111.631 178.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -70.87 -29.47 65.58 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 123.307 0.643 . . . . 0.0 110.432 -178.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.502 HD11 ' HA ' ' A' ' 37' ' ' PRO . 32.9 mt -72.58 -37.02 68.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.437 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -62.3 -44.3 96.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.202 0.601 . . . . 0.0 110.764 172.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.498 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.0 mt-10 -60.88 -39.79 90.55 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.564 0.746 . . . . 0.0 111.657 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.63 -44.51 77.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 123.648 0.592 . . . . 0.0 111.245 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.49 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -69.14 -26.01 64.66 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.139 0.976 . . . . 0.0 111.162 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 1.9 tmmm? -77.13 -42.71 36.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.791 0.837 . . . . 0.0 109.677 177.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.27 -36.36 77.03 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.573 0.749 . . . . 0.0 110.406 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.402 ' HG ' ' HB3' ' A' ' 54' ' ' ALA . 97.7 p -87.79 -5.25 58.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.531 0.732 . . . . 0.0 111.323 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.9 m120 64.68 24.02 12.87 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.545 1.138 . . . . 0.0 112.106 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.49 -2.88 30.87 Favored Glycine 0 C--N 1.347 1.143 0 CA-C-N 115.959 -0.564 . . . . 0.0 113.203 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -86.15 100.25 12.08 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.2 tt -66.62 -24.82 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.141 0.576 . . . . 0.0 112.146 -172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.8 m -67.93 -45.76 73.4 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.507 0.723 . . . . 0.0 110.191 176.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -70.22 -29.97 66.93 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.875 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.402 ' HB3' ' HG ' ' A' ' 47' ' ' SER . . . -64.9 -51.48 61.72 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 123.442 0.697 . . . . 0.0 111.375 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.25 -38.96 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.022 177.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -54.29 -47.54 72.26 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 124.355 1.035 . . . . 0.0 110.297 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.21 -45.28 92.38 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 123.759 0.662 . . . . 0.0 111.311 179.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.643 HD11 HD11 ' A' ' 34' ' ' ILE . 84.6 mt -71.06 -15.48 62.54 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.583 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 68.0 p -116.64 1.16 12.81 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 122.986 0.514 . . . . 0.0 112.216 176.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -32.68 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.033 0.444 . . . . 0.0 109.999 174.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -70.82 -10.26 59.19 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.547 -177.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 33.1 ptt180 -95.22 -33.3 12.65 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.732 0.413 . . . . 0.0 110.364 175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.8 p -98.76 19.13 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.888 0.875 . . . . 0.0 110.107 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.09 111.83 1.32 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.413 1.085 . . . . 0.0 111.277 174.167 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -56.43 132.62 76.64 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 122.963 0.505 . . . . 0.0 111.462 166.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.19 128.56 16.64 Favored 'Cis proline' 0 C--N 1.375 1.973 0 C-N-CA 124.579 -1.009 . . . . 0.0 113.283 -0.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 64.9 p -153.86 157.16 38.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 0.0 109.311 176.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -148.4 111.44 4.87 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.206 0.602 . . . . 0.0 109.88 177.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -160.83 158.4 28.33 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.7 t -93.06 166.69 12.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.895 0.478 . . . . 0.0 111.563 -174.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.4 t -84.77 107.48 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 123.347 0.659 . . . . 0.0 110.173 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.48 -5.84 38.59 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.446 0.698 . . . . 0.0 110.823 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.1 m -89.36 101.27 13.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.3 0.64 . . . . 0.0 109.379 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.1 121.07 80.22 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 110.619 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.92 71.38 5.59 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 123.248 2.632 . . . . 0.0 110.849 170.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.3 p -74.58 82.03 2.01 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.242 1.017 . . . . 0.0 110.396 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -101.21 83.28 2.46 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.5 m -127.85 140.47 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.595 0.758 . . . . 0.0 110.478 -173.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -89.88 147.26 23.86 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.575 0.75 . . . . 0.0 109.315 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -104.4 25.86 24.61 Favored Glycine 0 N--CA 1.476 1.329 0 O-C-N 123.368 0.418 . . . . 0.0 112.377 175.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.7 p -84.14 94.78 8.44 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.733 0.813 . . . . 0.0 110.14 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -140.27 39.7 1.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.863 0.865 . . . . 0.0 109.692 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -76.34 101.06 5.36 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.584 0.754 . . . . 0.0 110.124 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.0 p-10 -138.17 101.08 4.31 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.876 0.871 . . . . 0.0 109.036 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -79.32 78.99 5.79 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.714 0.768 . . . . 0.0 109.433 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -122.36 156.09 34.66 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.974 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.7 t -92.05 139.75 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.477 0.711 . . . . 0.0 109.194 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.21 41.88 1.03 Allowed 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.873 0.869 . . . . 0.0 109.478 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -89.29 140.4 29.53 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.396 0.679 . . . . 0.0 109.715 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.72 153.08 14.45 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.397 0.679 . . . . 0.0 109.621 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 35.7 t -127.73 69.26 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 176.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 30.5 mm -116.41 75.84 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.53 76.83 6.14 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.785 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.99 -14.91 33.0 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.01 0.924 . . . . 0.0 109.206 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.7 m -64.25 93.46 0.09 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.813 0.845 . . . . 0.0 111.328 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -90.46 127.76 36.31 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.189 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -98.82 123.77 43.27 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 48.9 m-20 -78.14 91.3 4.31 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -60.47 149.6 33.81 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.006 0.923 . . . . 0.0 111.5 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.93 -13.38 4.39 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.132 1.773 . . . . 0.0 114.717 -174.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.41 -60.91 2.66 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.929 0.891 . . . . 0.0 112.559 -178.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.72 60.95 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.115 0.416 . . . . 0.0 111.436 -177.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.61 -42.75 88.87 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 170.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.29 -38.9 78.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.94 0.896 . . . . 0.0 110.726 -178.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.31 84.19 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.182 0.926 . . . . 0.0 111.397 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.14 -46.21 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.42 0.688 . . . . 0.0 110.195 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.48 81.09 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.656 0.782 . . . . 0.0 111.216 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.1 tp -66.46 -52.14 49.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.479 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.8 m -68.35 -26.47 65.61 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -172.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -91.81 -36.22 13.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.651 0.38 . . . . 0.0 111.216 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.7 -1.79 56.56 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -73.88 -164.62 0.24 Allowed 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.482 0.658 . . . . 0.0 111.298 173.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.1 p -134.3 121.86 15.67 Favored Pre-proline 0 C--O 1.244 0.766 0 C-N-CA 123.861 0.864 . . . . 0.0 109.236 -178.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -61.7 114.56 2.32 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.353 2.035 . . . . 0.0 110.68 170.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.521 ' HD3' ' H ' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -87.63 16.31 5.78 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.068 0.547 . . . . 0.0 111.091 -179.042 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -61.94 106.43 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 123.568 0.747 . . . . 0.0 109.966 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -102.18 -40.27 6.87 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.597 0.759 . . . . 0.0 110.793 -176.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.73 6.55 15.01 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -170.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 60.6 92.92 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.532 1.133 . . . . 0.0 110.189 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 78.58 103.17 0.21 Allowed Glycine 0 C--N 1.341 0.836 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 -166.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 74.42 142.28 0.07 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 125.772 1.629 . . . . 0.0 110.914 -174.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.9 -48.17 7.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.08 0.952 . . . . 0.0 110.753 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -165.3 127.03 2.04 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -144.78 145.48 31.68 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.428 0.691 . . . . 0.0 109.302 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -142.54 24.86 1.88 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.997 0.919 . . . . 0.0 109.998 -178.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.45 ' HB3' ' HG2' ' A' ' 128' ' ' GLU . 1.9 mpt? -116.22 130.52 56.83 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.348 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -94.06 17.31 12.65 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.324 0.65 . . . . 0.0 111.495 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.45 ' HG2' ' HB3' ' A' ' 126' ' ' MET . 12.5 pt-20 -75.21 130.67 39.54 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.125 0.57 . . . . 0.0 109.628 173.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.55 153.05 21.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.636 0.775 . . . . 0.0 109.291 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 22.5 m -63.34 96.3 0.11 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.096 0.559 . . . . 0.0 110.375 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -87.04 -19.27 28.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.919 0.888 . . . . 0.0 110.494 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.138 0.975 . . . . 0.0 109.376 177.524 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 119.688 -0.196 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -55.48 -57.11 13.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.733 0.813 . . . . 0.0 111.205 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.609 ' HG ' HD23 ' A' ' 25' ' ' LEU . 1.2 pt? -56.39 -35.59 67.92 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.463 0.705 . . . . 0.0 111.886 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.609 HD23 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -61.74 -62.81 1.54 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.33 0.652 . . . . 0.0 109.632 178.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.48 -43.12 95.16 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 124.813 1.321 . . . . 0.0 111.401 -171.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.463 ' O ' HG12 ' A' ' 31' ' ' ILE . 7.1 mm100 -66.07 -52.12 51.77 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.748 -178.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.567 HD23 ' HA ' ' A' ' 40' ' ' LEU . 20.6 tp -62.5 -44.66 95.83 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -57.98 -31.33 66.8 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.666 1.186 . . . . 0.0 111.77 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -71.77 -52.2 18.84 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.313 0.645 . . . . 0.0 110.496 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 27' ' ' GLN . 15.1 pt -89.65 3.45 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 p -114.41 -51.25 2.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 167.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.53 -2.05 34.47 Favored Glycine 0 C--N 1.341 0.844 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.836 -175.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.469 HD11 HD11 ' A' ' 58' ' ' LEU . 81.7 mt -82.21 120.68 34.15 Favored 'Isoleucine or valine' 0 C--N 1.351 0.67 0 C-N-CA 123.579 0.751 . . . . 0.0 110.58 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -79.98 -26.27 40.01 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.39 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 7.4 m-20 -64.24 110.69 4.21 Favored Pre-proline 0 N--CA 1.479 1.012 0 C-N-CA 124.668 1.187 . . . . 0.0 111.225 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.21 -26.23 57.06 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.833 2.355 . . . . 0.0 112.378 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 m -58.16 -52.14 66.78 Favored 'General case' 0 C--N 1.356 0.87 0 C-N-CA 123.739 0.816 . . . . 0.0 110.113 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -57.35 -37.59 72.8 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.274 0.984 . . . . 0.0 110.991 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.567 ' HA ' HD23 ' A' ' 28' ' ' LEU . 58.7 mt -70.7 -48.48 54.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 124.172 0.92 . . . . 0.0 111.486 -174.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -68.71 -38.91 80.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.929 0.492 . . . . 0.0 111.23 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.561 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.4 mt-10 -68.1 -37.25 80.98 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.226 0.61 . . . . 0.0 111.754 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.43 -43.81 72.62 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.797 0.686 . . . . 0.0 110.685 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.525 ' HG ' ' HB2' ' A' ' 24' ' ' LEU . 3.4 mm? -62.84 -35.74 80.93 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.96 0.904 . . . . 0.0 111.03 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.2 tmmm? -68.19 -47.1 68.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.708 0.803 . . . . 0.0 110.464 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.09 -19.89 61.06 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.771 0.828 . . . . 0.0 111.74 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.6 p -96.67 -0.71 48.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.455 0.702 . . . . 0.0 111.292 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 64.51 21.9 12.56 Favored 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 124.761 1.225 . . . . 0.0 111.089 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -16.18 24.98 Favored Glycine 0 C--N 1.348 1.225 0 CA-C-N 115.978 -0.555 . . . . 0.0 113.306 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -76.97 102.35 6.38 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-N 117.328 0.564 . . . . 0.0 110.459 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.9 tt -60.24 -25.72 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.665 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 29.0 m -67.86 -47.78 67.94 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.15 0.58 . . . . 0.0 110.709 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.42 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 7.9 mm-40 -65.47 -34.73 78.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.543 0.337 . . . . 0.0 110.657 175.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.16 -42.34 90.5 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.362 0.665 . . . . 0.0 110.885 178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.24 -52.15 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 123.798 0.686 . . . . 0.0 109.723 171.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.4 m -56.76 -33.26 66.42 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.126 0.892 . . . . 0.0 112.434 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -79.7 -36.17 37.96 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.567 0.747 . . . . 0.0 111.177 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.469 HD11 HD11 ' A' ' 34' ' ' ILE . 68.4 mt -76.0 -25.2 55.54 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 175.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.5 p -93.16 10.9 29.76 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.42 0.688 . . . . 0.0 111.426 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -52.21 -38.71 58.76 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.959 0.904 . . . . 0.0 111.277 175.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -59.24 -26.88 65.26 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.244 1.018 . . . . 0.0 113.396 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -104.54 -26.82 12.21 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 118.121 0.419 . . . . 0.0 111.325 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.1 p -102.38 9.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.078 0.551 . . . . 0.0 110.992 -175.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -67.37 100.15 0.8 Allowed 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 121.744 0.783 . . . . 0.0 110.103 175.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.34 151.08 83.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.484 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -78.22 158.62 93.43 Favored 'Cis proline' 0 C--N 1.383 2.361 0 CA-C-N 119.755 0.948 . . . . 0.0 113.573 4.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -152.22 124.28 8.08 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 123.88 0.872 . . . . 0.0 109.531 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -75.55 92.93 2.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.301 0.641 . . . . 0.0 109.358 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -157.05 159.76 38.27 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.878 0.871 . . . . 0.0 109.476 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.2 t -62.62 107.05 0.87 Allowed 'General case' 0 CA--C 1.554 1.11 0 CA-C-O 121.893 0.854 . . . . 0.0 110.958 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.3 m -97.33 141.51 15.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 115.065 -0.971 . . . . 0.0 109.876 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.44 78.4 4.91 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.229 0.538 . . . . 0.0 109.717 178.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.1 t -108.08 129.09 55.17 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 123.698 0.799 . . . . 0.0 109.309 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -85.63 142.59 37.33 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.81 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -58.02 151.64 56.69 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 123.462 2.775 . . . . 0.0 113.79 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.3 t -141.57 143.63 33.83 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.027 0.931 . . . . 0.0 109.093 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.84 -10.73 59.78 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.01 0.524 . . . . 0.0 111.688 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.8 t -75.33 81.45 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-O 121.648 0.737 . . . . 0.0 109.462 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -98.26 169.15 9.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.1 0.96 . . . . 0.0 110.278 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 121.64 -32.4 4.66 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.815 -178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 42.0 p -78.72 6.46 8.87 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.963 0.905 . . . . 0.0 112.358 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.05 -25.31 62.58 Favored 'General case' 0 C--N 1.355 0.816 0 C-N-CA 123.744 0.818 . . . . 0.0 110.773 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.22 84.14 1.87 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.563 0.745 . . . . 0.0 111.29 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -99.02 -63.99 1.07 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt 58.95 86.37 0.09 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.442 1.497 . . . . 0.0 111.291 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.24 48.99 0.84 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 110.041 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 22.9 m -63.2 155.53 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.262 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 mt -89.21 12.51 15.71 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.141 0.977 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -93.53 117.88 30.64 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.228 1.011 . . . . 0.0 110.563 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.45 166.37 31.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.397 1.079 . . . . 0.0 109.556 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.1 p -100.15 30.88 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 CA-C-O 122.155 0.979 . . . . 0.0 111.295 -174.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.7 mt -91.27 68.63 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -87.96 80.87 7.64 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.98 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.96 -10.41 59.46 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.357 174.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 45.1 p -59.43 -53.6 56.28 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.812 1.245 . . . . 0.0 111.37 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -106.89 89.72 3.09 Favored 'General case' 0 C--O 1.245 0.832 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 172.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -144.61 86.11 1.8 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.294 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -72.46 134.09 45.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.044 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -86.25 137.85 32.3 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.147 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -86.16 17.64 3.52 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.43 1.092 . . . . 0.0 112.053 -176.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -59.67 -66.69 0.47 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.47 1.108 . . . . 0.0 111.409 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -22.96 61.4 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.509 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -58.84 -47.07 86.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -34.76 72.91 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.19 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.05 77.33 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.474 0.71 . . . . 0.0 111.735 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.99 -41.36 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 123.568 0.747 . . . . 0.0 110.484 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -61.84 -51.8 66.76 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.663 0.602 . . . . 0.0 110.489 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 34.6 tp -61.33 -40.4 94.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.324 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -59.6 -40.02 86.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.487 0.715 . . . . 0.0 111.469 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.27 -39.32 92.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.576 0.751 . . . . 0.0 109.645 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 60.4 mt -77.54 -24.52 49.88 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.418 0.687 . . . . 0.0 112.097 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 108' ' ' LEU . 18.5 mm-40 -75.99 -47.16 26.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.204 0.601 . . . . 0.0 110.397 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.5 p -70.0 133.08 88.12 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.99 175.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.6 146.24 66.73 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.204 1.936 . . . . 0.0 111.165 175.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -11.44 57.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.029 0.531 . . . . 0.0 109.945 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 45.8 mm -42.82 119.71 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 125.651 1.58 . . . . 0.0 111.995 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.38 -37.58 87.44 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.074 0.55 . . . . 0.0 111.013 -176.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -174.15 163.72 3.93 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.078 0.951 . . . . 0.0 109.702 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.1 t70 63.89 -85.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.463 1.105 . . . . 0.0 111.467 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -173.49 33.1 0.11 Allowed Glycine 0 C--N 1.342 0.863 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.23 153.08 42.45 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.252 1.021 . . . . 0.0 110.675 -171.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -127.54 100.68 6.1 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.948 0.899 . . . . 0.0 108.815 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 43.1 tp 59.38 -76.08 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.78 1.632 . . . . 0.0 112.111 -174.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 25.41 -72.37 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 128.003 2.521 . . . . 0.0 116.923 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.14 78.01 8.87 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 109.905 -173.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 14.1 tpt -78.2 129.33 34.99 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 173.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -68.72 154.06 42.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.833 0.453 . . . . 0.0 109.853 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.03 127.86 33.29 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.883 0.473 . . . . 0.0 109.967 176.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -104.94 79.44 1.51 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.947 0.499 . . . . 0.0 109.707 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 34.4 m -110.5 112.09 23.78 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 m -77.14 113.63 15.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.515 0.726 . . . . 0.0 109.77 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.88 0.872 . . . . 0.0 108.9 179.11 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 N--CA 1.485 1.31 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.0 tpt -50.11 -48.69 53.34 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.382 1.073 . . . . 0.0 112.989 -172.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.515 HD11 ' HG ' ' A' ' 44' ' ' LEU . 2.2 pt? -59.17 -39.49 82.66 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.648 0.779 . . . . 0.0 112.737 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -70.54 -37.63 74.08 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.328 0.251 . . . . 0.0 110.371 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.85 -45.26 90.28 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.259 0.975 . . . . 0.0 110.211 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -62.24 -51.32 68.23 Favored 'General case' 0 C--N 1.349 0.564 0 O-C-N 124.422 1.077 . . . . 0.0 110.822 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' A' ' 40' ' ' LEU . 14.7 tp -63.79 -44.21 94.01 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.891 0.745 . . . . 0.0 110.629 -176.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttt-85 -54.25 -41.81 69.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.274 1.03 . . . . 0.0 110.933 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.1 -34.69 61.76 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.449 -174.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.06 -9.08 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.411 HG22 HG21 ' A' ' 55' ' ' VAL . 72.3 p -102.37 -53.51 2.88 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 171.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.49 -11.44 25.94 Favored Glycine 0 N--CA 1.47 0.911 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.243 -172.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.442 HD12 HD11 ' A' ' 58' ' ' LEU . 78.9 mt -73.95 118.82 20.06 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 110.151 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -85.04 -22.5 28.98 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.963 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -62.39 111.87 5.45 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.866 0.866 . . . . 0.0 110.688 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -62.47 -32.75 80.36 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 122.894 2.396 . . . . 0.0 112.509 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.2 m -54.47 -50.8 66.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.638 0.775 . . . . 0.0 110.79 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -57.0 -37.84 72.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.233 1.013 . . . . 0.0 111.146 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.57 ' HA ' HD22 ' A' ' 28' ' ' LEU . 40.5 mt -72.63 -50.85 22.43 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.777 -1.102 . . . . 0.0 111.293 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -60.74 -44.97 96.02 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.477 0.711 . . . . 0.0 111.205 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -66.02 -36.5 83.42 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.014 0.926 . . . . 0.0 112.086 -178.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.8 -41.94 70.95 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.125 0.265 . . . . 0.0 110.423 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.515 ' HG ' HD11 ' A' ' 24' ' ' LEU . 2.4 mm? -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.945 0.898 . . . . 0.0 110.59 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 54.6 pttt -77.29 -32.23 55.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.549 0.339 . . . . 0.0 110.506 -174.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.67 -24.98 60.05 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.013 0.525 . . . . 0.0 111.187 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.4 p -93.26 3.28 55.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.771 0.828 . . . . 0.0 111.217 175.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 t30 72.04 7.2 5.75 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.348 1.459 . . . . 0.0 112.041 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 21.47 4.51 Favored Glycine 0 N--CA 1.473 1.148 0 C-N-CA 123.578 0.609 . . . . 0.0 112.106 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -104.38 116.5 32.24 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.402 0.681 . . . . 0.0 109.462 -174.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 7.8 tp -65.39 -32.88 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.154 0.582 . . . . 0.0 111.888 -175.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -75.52 -41.66 54.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.697 0.799 . . . . 0.0 111.379 -175.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -75.1 -27.65 59.94 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.351 -0.218 . . . . 0.0 110.59 176.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.29 71.0 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.227 0.611 . . . . 0.0 111.256 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.411 HG21 HG22 ' A' ' 32' ' ' THR . 13.7 p -65.84 -34.4 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.713 0.405 . . . . 0.0 109.998 176.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.0 t -63.5 -39.2 93.82 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 123.806 0.691 . . . . 0.0 111.524 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.25 -31.92 66.22 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.689 . . . . 0.0 111.518 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.442 HD11 HD12 ' A' ' 34' ' ' ILE . 57.7 mt -81.84 -26.8 33.96 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -92.81 -0.03 57.33 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 117.987 0.358 . . . . 0.0 110.968 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.64 -40.07 59.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.151 0.98 . . . . 0.0 111.793 174.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -56.31 -41.54 76.15 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.408 1.083 . . . . 0.0 112.951 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -88.35 -35.24 17.28 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.688 0.395 . . . . 0.0 110.708 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.59 20.55 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.427 0.691 . . . . 0.0 110.242 -178.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -64.9 93.24 0.11 Allowed 'General case' 0 C--N 1.354 0.789 0 C-N-CA 124.334 1.054 . . . . 0.0 109.982 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.522 ' HA ' ' N ' ' A' ' 67' ' ' SER . 1.5 pp20? -65.22 140.91 98.03 Favored Pre-proline 0 CA--C 1.554 1.121 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.612 -176.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -75.32 100.4 0.3 Allowed 'Cis proline' 0 C--N 1.385 2.471 0 CA-C-N 120.036 1.049 . . . . 0.0 112.386 -1.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.522 ' N ' ' HA ' ' A' ' 65' ' ' GLU . 42.4 t -86.72 -64.52 1.14 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.921 0.888 . . . . 0.0 108.803 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -83.0 123.07 29.1 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -75.55 -29.52 59.42 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.576 0.35 . . . . 0.0 110.257 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 49.2 m -78.8 97.93 6.11 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 121.047 0.451 . . . . 0.0 109.796 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 10.5 m -136.11 155.16 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.102 0.961 . . . . 0.0 110.14 176.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -139.0 9.06 2.54 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.555 171.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.5 m -79.05 100.8 7.51 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.126 0.97 . . . . 0.0 110.326 -176.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.63 124.19 49.32 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 123.8 0.84 . . . . 0.0 110.412 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -76.25 134.94 16.32 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.079 1.852 . . . . 0.0 111.882 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.9 t -78.73 84.47 4.81 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.671 0.748 . . . . 0.0 109.38 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -132.1 25.7 4.57 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.375 -176.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 11.0 t -106.77 34.1 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-O 122.353 1.073 . . . . 0.0 109.319 -172.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -80.44 146.55 31.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.901 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 71.64 13.33 74.67 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.05 -0.523 . . . . 0.0 113.22 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.4 t -87.28 -0.2 56.38 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.746 0.818 . . . . 0.0 111.195 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -85.22 50.23 1.91 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.815 0.846 . . . . 0.0 109.817 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -115.81 138.0 51.55 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.556 1.143 . . . . 0.0 109.314 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -126.43 143.2 51.26 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -164.61 110.15 0.98 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.194 0.598 . . . . 0.0 109.713 173.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -126.5 167.25 15.86 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.477 1.111 . . . . 0.0 108.947 175.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.0 m -92.38 167.91 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 120.97 0.414 . . . . 0.0 110.362 173.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.34 83.03 1.41 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 170.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.77 76.44 1.58 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.93 0.892 . . . . 0.0 112.224 -172.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.431 ' H ' ' HD3' ' A' ' 90' ' ' LYS . 0.3 OUTLIER -59.79 152.87 21.93 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.421 166.297 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.471 HG23 ' HB3' ' A' ' 93' ' ' ASP . 29.5 m -113.15 27.74 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 122.951 0.5 . . . . 0.0 110.93 -177.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.6 mt 55.21 25.11 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 125.565 1.546 . . . . 0.0 110.962 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.471 ' HB3' HG23 ' A' ' 91' ' ' VAL . 6.1 p-10 -65.68 94.85 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.652 1.181 . . . . 0.0 112.243 -171.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.1 tt 74.13 -29.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.574 1.549 . . . . 0.0 112.598 178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.3 t -63.87 103.91 0.63 Allowed 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 122.282 1.039 . . . . 0.0 112.35 -171.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -138.99 121.82 16.54 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 124.466 1.107 . . . . 0.0 108.253 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -80.29 75.8 7.1 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -77.46 145.74 36.9 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.999 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -67.32 155.67 38.32 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.634 0.584 . . . . 0.0 110.712 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -71.99 2.81 5.07 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 124.682 1.193 . . . . 0.0 112.604 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -53.25 -58.51 6.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.116 1.366 . . . . 0.0 112.567 -173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -34.28 76.99 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.164 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -62.42 -39.38 93.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.596 0.758 . . . . 0.0 110.577 175.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.66 -42.46 67.5 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.253 0.971 . . . . 0.0 110.747 -175.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.43 -45.57 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.988 0.805 . . . . 0.0 111.295 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.8 mm -65.42 -46.24 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.321 0.649 . . . . 0.0 110.467 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.8 78.34 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.539 0.735 . . . . 0.0 111.224 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.98 -47.41 74.63 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -69.26 -24.46 63.98 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -177.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -83.64 -44.45 14.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.187 0.595 . . . . 0.0 111.429 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -76.8 -55.86 5.12 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -82.59 125.24 30.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.65 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.6 m -97.79 147.78 33.53 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.845 0.858 . . . . 0.0 109.713 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.04 142.19 86.68 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.36 2.04 . . . . 0.0 111.851 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -20.91 63.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.278 0.561 . . . . 0.0 110.481 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 14.6 mt -117.24 60.72 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 170.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -78.53 -36.62 44.54 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.573 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -157.93 90.13 1.05 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.8 t70 57.31 38.83 28.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.516 1.126 . . . . 0.0 110.55 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -74.46 -106.03 0.09 OUTLIER Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.487 -176.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -91.44 27.64 1.91 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.185 0.594 . . . . 0.0 110.971 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.81 -42.41 95.01 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.101 0.961 . . . . 0.0 111.733 -173.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.5 tp 67.24 78.43 0.25 Allowed 'General case' 0 C--O 1.242 0.705 0 O-C-N 124.944 1.403 . . . . 0.0 110.303 -173.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -107.48 90.73 3.39 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.189 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -139.25 -175.8 4.3 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.262 1.025 . . . . 0.0 109.956 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.28 169.02 21.74 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.773 0.829 . . . . 0.0 109.083 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.04 142.89 23.84 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -130.13 125.12 34.3 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.463 0.705 . . . . 0.0 109.511 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -172.09 122.35 0.48 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.34 1.456 . . . . 0.0 108.492 175.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 6.2 t -78.01 81.51 4.4 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-O 122.422 1.106 . . . . 0.0 110.593 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 26.8 m -73.81 107.79 6.26 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.292 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.03 0 C-N-CA 123.65 0.78 . . . . 0.0 110.348 -176.184 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 51.7 ttm -53.4 -57.66 9.84 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.987 0.915 . . . . 0.0 111.814 -177.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.596 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.0 pt? -57.05 -34.98 68.8 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.738 0.815 . . . . 0.0 112.08 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.596 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -64.76 -51.88 59.97 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.859 0.464 . . . . 0.0 110.069 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -62.47 -49.86 73.74 Favored 'General case' 0 N--CA 1.484 1.229 0 O-C-N 124.688 1.242 . . . . 0.0 110.498 -174.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -55.24 -54.96 36.78 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.793 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.559 HD22 ' HA ' ' A' ' 40' ' ' LEU . 14.6 tp -70.73 -40.78 72.56 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 123.342 0.401 . . . . 0.0 111.024 -175.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -54.91 -38.05 67.13 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.179 0.992 . . . . 0.0 111.272 176.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -75.71 -42.07 51.81 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.877 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.453 HG12 ' HA ' ' A' ' 28' ' ' LEU . 27.7 pt -86.23 -10.15 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.445 HG21 HG23 ' A' ' 55' ' ' VAL . 77.6 p -103.77 -50.84 3.31 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.428 0.632 . . . . 0.0 109.868 173.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.52 -4.61 32.9 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.541 -174.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.51 HD11 HD12 ' A' ' 58' ' ' LEU . 73.8 mt -81.0 118.8 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 124.263 1.025 . . . . 0.0 110.4 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -84.12 -18.65 36.13 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.054 -178.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 13.9 t70 -69.06 119.61 71.09 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.53 0.732 . . . . 0.0 110.27 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -69.29 -29.58 25.9 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.766 2.311 . . . . 0.0 113.287 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -63.34 -48.72 76.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.086 0.554 . . . . 0.0 110.242 -176.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -55.46 -38.62 69.31 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 124.257 0.973 . . . . 0.0 111.454 177.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.559 ' HA ' HD22 ' A' ' 28' ' ' LEU . 45.5 mt -69.57 -46.87 65.38 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.872 0.733 . . . . 0.0 110.89 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.12 -43.39 98.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.191 0.596 . . . . 0.0 111.267 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.512 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 49.2 mt-10 -70.75 -30.39 66.89 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.612 0.765 . . . . 0.0 111.833 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.58 -42.99 60.86 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 123.379 0.424 . . . . 0.0 110.347 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.438 ' HG ' HD11 ' A' ' 24' ' ' LEU . 3.5 mm? -66.19 -29.8 70.15 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.826 0.85 . . . . 0.0 110.21 176.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.512 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.3 tmmm? -75.21 -43.28 52.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 110.48 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.15 77.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.331 0.652 . . . . 0.0 110.738 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.9 p -88.53 -6.74 57.4 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.46 0.704 . . . . 0.0 111.405 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 66.48 13.18 9.15 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.083 1.353 . . . . 0.0 111.825 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.01 -14.79 5.42 Favored Glycine 0 C--N 1.351 1.394 0 CA-C-O 119.744 -0.476 . . . . 0.0 113.489 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -78.27 102.49 7.67 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.197 0.499 . . . . 0.0 109.935 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.1 tt -65.04 -27.01 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.5 m -68.26 -41.94 80.34 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 121.428 0.633 . . . . 0.0 110.348 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -72.27 -33.24 67.32 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.4 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.98 -51.05 70.88 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.541 0.736 . . . . 0.0 111.386 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.445 HG23 HG21 ' A' ' 32' ' ' THR . 7.7 p -64.01 -39.81 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.195 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.2 t -60.23 -33.22 71.96 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.525 0.516 . . . . 0.0 111.905 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 99.3 mt -77.93 -36.28 49.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.001 0.52 . . . . 0.0 111.522 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.51 HD12 HD11 ' A' ' 34' ' ' ILE . 73.2 mt -78.32 -18.44 55.19 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 70.6 p -104.47 11.04 34.94 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.205 0.602 . . . . 0.0 111.008 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.89 -27.73 69.35 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.792 0.837 . . . . 0.0 111.616 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.11 -30.05 62.13 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.748 -177.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 59' ' ' THR . 13.0 ptm180 -89.65 -8.75 51.78 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -124.3 79.59 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 CA-C-O 122.503 1.144 . . . . 0.0 109.386 174.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.463 ' HB2' ' NZ ' ' A' ' 64' ' ' LYS . 2.5 ttmp? -166.16 102.64 0.64 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.014 178.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -69.06 160.27 79.23 Favored Pre-proline 0 CA--C 1.566 1.567 0 C-N-CA 124.02 0.928 . . . . 0.0 111.383 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -88.9 102.49 0.34 Allowed 'Cis proline' 0 C--N 1.384 2.399 0 CA-C-N 120.138 1.085 . . . . 0.0 113.29 -5.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.2 m -67.77 -47.59 68.77 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 170.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -93.53 118.08 30.9 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.934 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -75.01 129.85 38.34 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 t -165.25 168.6 16.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.832 0.853 . . . . 0.0 109.382 -174.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.8 m -74.39 144.85 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 167.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.51 21.4 10.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.506 0.722 . . . . 0.0 111.046 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.6 m 65.89 28.57 10.66 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 125.014 1.325 . . . . 0.0 110.892 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.43 154.28 62.53 Favored Pre-proline 0 CA--C 1.554 1.107 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.619 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.0 -168.7 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.746 0 C-N-CA 122.409 2.073 . . . . 0.0 112.826 176.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.1 t -69.82 93.13 0.72 Allowed 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.259 0.552 . . . . 0.0 110.834 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -86.9 -17.79 32.4 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.836 0.854 . . . . 0.0 110.897 177.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 87.1 t -74.39 123.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 172.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.91 159.66 22.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.942 0.897 . . . . 0.0 111.445 -174.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -116.01 87.37 0.44 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.606 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.2 m -53.37 141.59 24.02 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.816 0.846 . . . . 0.0 111.977 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -83.1 71.7 10.14 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.685 0.794 . . . . 0.0 108.898 176.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.07 71.43 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.191 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 59.96 58.34 2.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.956 1.302 . . . . 0.0 112.019 170.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -102.99 130.25 50.02 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.018 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.53 145.39 49.16 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.913 . . . . 0.0 111.566 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 30.1 m -81.81 150.29 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.924 0.49 . . . . 0.0 110.459 173.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.2 pp -108.78 29.96 6.96 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.618 0.767 . . . . 0.0 110.901 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -85.83 153.0 22.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.711 0.804 . . . . 0.0 110.203 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 148.85 38.9 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.418 0.687 . . . . 0.0 109.715 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -122.91 24.66 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 CA-C-O 121.293 0.568 . . . . 0.0 110.798 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.6 mm 50.06 70.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 CA-C-O 122.855 1.312 . . . . 0.0 109.353 -172.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -120.31 29.87 7.26 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 113.509 -1.678 . . . . 0.0 110.152 -172.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 pp -87.49 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.663 1.185 . . . . 0.0 111.415 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.6 p -68.3 127.85 34.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.743 0.817 . . . . 0.0 110.628 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -91.34 146.15 24.05 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.462 0.705 . . . . 0.0 110.685 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.64 156.8 28.96 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.529 175.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -68.22 117.62 10.27 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.734 0.814 . . . . 0.0 110.258 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.502 ' HG3' ' H ' ' A' ' 101' ' ' ASP . 17.4 tppt? -62.16 144.26 55.65 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.993 0.917 . . . . 0.0 111.461 -173.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.55 0.77 13.78 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.445 1.098 . . . . 0.0 112.596 -177.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.502 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 21.0 t70 -54.38 -70.51 0.1 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.8 1.24 . . . . 0.0 111.906 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -30.52 69.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.225 0.61 . . . . 0.0 112.053 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -65.62 -48.24 72.92 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.028 0.531 . . . . 0.0 110.158 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.04 70.35 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.626 0.579 . . . . 0.0 111.12 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -56.16 20.05 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.085 0.554 . . . . 0.0 111.013 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -72.8 -41.92 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.324 0.65 . . . . 0.0 110.673 -175.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.35 96.15 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.944 0.498 . . . . 0.0 111.554 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 54.5 tp -63.6 -46.68 84.7 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -59.37 -24.73 63.65 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.17 0.588 . . . . 0.0 112.406 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.78 -44.4 49.73 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.75 -8.75 59.44 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.888 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 108' ' ' LEU . 12.2 mm-40 -68.26 149.06 49.93 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.052 0.453 . . . . 0.0 110.139 173.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.2 m -115.85 155.29 47.91 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.111 0.964 . . . . 0.0 110.41 -171.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.79 131.11 35.84 Favored 'Trans proline' 0 C--N 1.381 2.262 0 C-N-CA 122.051 1.834 . . . . 0.0 110.946 172.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -67.44 -45.15 76.87 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 2.2 mp -86.29 114.76 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 168.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -56.18 -33.87 65.68 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.938 0.895 . . . . 0.0 113.366 -171.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.541 ' O ' ' HG2' ' A' ' 121' ' ' ARG . . . -81.94 84.56 6.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.864 0.466 . . . . 0.0 110.363 175.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 63.12 3.05 1.18 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 124.858 1.263 . . . . 0.0 114.029 170.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 74.19 64.4 2.42 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 117.933 0.333 . . . . 0.0 112.921 -173.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 118' ' ' ALA . 31.2 mmt180 -83.57 37.74 0.59 Allowed 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.303 0.641 . . . . 0.0 111.911 176.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -55.06 -37.25 66.51 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.893 0.877 . . . . 0.0 112.373 176.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tt -138.99 72.8 1.41 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -164.54 163.93 21.86 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.546 -1.207 . . . . 0.0 108.672 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 63.02 28.48 16.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.558 1.143 . . . . 0.0 111.68 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ptm -90.82 5.1 49.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.83 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -151.45 154.39 36.5 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.496 0.719 . . . . 0.0 110.106 176.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.48 ' HG2' HG23 ' A' ' 130' ' ' THR . 41.6 tt0 -162.77 105.56 1.07 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 0.0 108.413 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -82.03 92.47 6.8 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.979 0.511 . . . . 0.0 110.882 -177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' THR . . . . . 0.48 HG23 ' HG2' ' A' ' 128' ' ' GLU . 12.6 t -170.33 174.4 5.28 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.946 0.898 . . . . 0.0 110.165 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 32.8 m -103.9 142.55 34.21 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.733 0.813 . . . . 0.0 110.418 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.96 0 C-N-CA 124.099 0.96 . . . . 0.0 109.223 179.393 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.7 ttt -55.52 -48.41 74.71 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.721 0.808 . . . . 0.0 112.233 -172.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.576 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -56.67 -38.86 72.79 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.728 0.811 . . . . 0.0 112.27 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.576 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -65.3 -46.11 81.71 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -63.23 -44.74 94.39 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 124.418 1.074 . . . . 0.0 111.271 -177.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -55.55 33.4 Favored 'General case' 0 C--N 1.349 0.55 0 O-C-N 124.532 1.145 . . . . 0.0 110.075 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.64 HD21 ' HA ' ' A' ' 40' ' ' LEU . 13.8 tp -66.61 -44.9 80.86 Favored 'General case' 0 C--N 1.351 0.665 0 O-C-N 124.213 0.946 . . . . 0.0 111.125 -174.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -56.93 -38.8 73.39 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.419 1.088 . . . . 0.0 111.605 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -71.62 -49.62 38.46 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.753 0.658 . . . . 0.0 110.641 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.483 HD12 HD13 ' A' ' 28' ' ' LEU . 14.6 pt -74.93 -30.21 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.3 p -87.2 -48.21 8.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.892 0.477 . . . . 0.0 110.152 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.37 4.92 54.82 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.665 -174.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.613 HD12 HD12 ' A' ' 58' ' ' LEU . 72.7 mt -84.85 124.8 40.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.865 0.866 . . . . 0.0 110.463 -177.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -90.21 -12.25 38.61 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.247 1.019 . . . . 0.0 112.61 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.415 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 8.0 m-20 -72.05 109.09 5.03 Favored Pre-proline 0 N--CA 1.475 0.816 0 O-C-N 123.787 0.68 . . . . 0.0 109.688 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -63.73 -28.64 68.64 Favored 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.0 2.466 . . . . 0.0 111.413 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.3 m -58.28 -51.98 67.49 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.118 0.967 . . . . 0.0 110.537 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -60.05 -34.42 73.38 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.718 0.807 . . . . 0.0 111.263 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.64 ' HA ' HD21 ' A' ' 28' ' ' LEU . 51.9 mt -69.88 -52.38 25.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.778 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -57.04 -49.84 74.6 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.751 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.4 -38.91 91.47 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.387 0.675 . . . . 0.0 112.373 -173.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.62 -42.2 82.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.462 0.476 . . . . 0.0 110.809 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.439 HD22 HD22 ' A' ' 28' ' ' LEU . 3.7 mm? -63.76 -32.8 74.42 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.856 0.862 . . . . 0.0 111.31 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 mpmm? -75.75 -41.61 52.76 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.836 0.454 . . . . 0.0 110.461 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.29 -27.28 67.04 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.07 0.948 . . . . 0.0 111.14 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -101.83 -1.63 31.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.792 0.837 . . . . 0.0 111.705 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 m120 64.68 16.97 10.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.964 1.306 . . . . 0.0 112.283 178.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.76 -13.57 13.1 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-O 119.51 -0.605 . . . . 0.0 113.126 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.4 109.05 5.14 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 109.773 -178.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.76 -28.94 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.591 0.756 . . . . 0.0 111.601 -172.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.7 m -71.85 -45.34 61.75 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.092 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.8 mm-40 -65.45 -40.44 93.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.876 0.471 . . . . 0.0 110.158 174.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.1 75.35 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.008 0.923 . . . . 0.0 111.869 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.2 p -64.73 -39.31 85.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.661 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.533 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.8 m -62.34 -36.55 82.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.384 0.673 . . . . 0.0 112.242 178.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.4 mt -71.64 -33.81 69.24 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.448 0.699 . . . . 0.0 111.007 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.613 HD12 HD12 ' A' ' 34' ' ' ILE . 79.6 mt -84.08 -26.68 28.82 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 176.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.433 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 82.8 p -96.27 12.59 30.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.098 0.559 . . . . 0.0 110.799 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -66.02 -17.74 64.88 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.903 0.881 . . . . 0.0 110.517 169.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.36 -27.9 61.75 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.554 1.141 . . . . 0.0 112.201 -177.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 59' ' ' THR . 37.3 ptt180 -61.79 -32.26 72.53 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.448 0.642 . . . . 0.0 110.316 176.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.5 p -119.3 32.57 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.821 1.248 . . . . 0.0 108.66 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -61.09 89.46 0.02 OUTLIER 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.069 0.948 . . . . 0.0 110.214 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -61.92 128.42 90.58 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.206 1.002 . . . . 0.0 110.958 -173.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -84.04 106.42 0.86 Allowed 'Cis proline' 0 C--N 1.381 2.281 0 C-N-CA 124.982 -0.841 . . . . 0.0 113.618 3.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.9 t -104.5 143.2 33.36 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.605 0.762 . . . . 0.0 109.742 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.04 -10.73 12.82 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.739 0.816 . . . . 0.0 111.447 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.91 -49.65 76.84 Favored 'General case' 0 C--N 1.362 1.121 0 C-N-CA 123.534 0.733 . . . . 0.0 110.29 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.0 p -110.3 142.9 41.28 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.6 t -67.62 102.15 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.21 68.28 2.6 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.051 0.94 . . . . 0.0 110.109 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.2 m -147.47 97.52 2.86 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 124.493 1.117 . . . . 0.0 108.404 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -112.32 159.55 33.53 Favored Pre-proline 0 CA--C 1.549 0.929 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -47.1 106.99 0.11 Allowed 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 123.466 2.777 . . . . 0.0 112.827 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.5 m -76.78 82.84 3.38 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.704 0.764 . . . . 0.0 110.004 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.27 17.44 16.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.886 1.274 . . . . 0.0 109.704 -177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 18.7 m -58.11 134.62 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 124.574 1.15 . . . . 0.0 112.039 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.97 107.93 10.87 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.191 0.596 . . . . 0.0 109.583 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.99 82.68 0.54 Allowed Glycine 0 C--N 1.339 0.733 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.83 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.0 t -68.76 140.21 55.33 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.434 0.694 . . . . 0.0 110.727 178.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -126.16 77.39 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.761 0.824 . . . . 0.0 109.702 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.26 38.4 1.26 Allowed 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.909 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -61.66 120.2 10.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.407 1.083 . . . . 0.0 111.249 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -155.63 136.4 13.5 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 175.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -125.67 133.97 52.0 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.3 m -69.23 159.84 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.19 0.596 . . . . 0.0 111.117 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.1 mp -89.27 19.64 4.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.717 0.807 . . . . 0.0 110.562 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -91.77 117.11 29.47 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 123.965 0.906 . . . . 0.0 109.671 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.1 168.05 26.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.843 0.857 . . . . 0.0 109.139 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.46 5.91 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 CA-C-O 121.856 0.836 . . . . 0.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 35.0 mt -89.46 72.52 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.304 1.042 . . . . 0.0 108.948 -173.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -93.73 147.06 23.39 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.246 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -148.26 39.96 0.93 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.378 0.671 . . . . 0.0 111.681 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 37.8 p -74.27 -64.27 1.06 Allowed 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.922 0.489 . . . . 0.0 111.858 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -98.27 18.23 16.82 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.222 0.609 . . . . 0.0 110.926 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -82.62 60.31 5.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.811 0.845 . . . . 0.0 110.788 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -108.76 131.45 54.94 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.486 ' HG3' ' H ' ' A' ' 101' ' ' ASP . 26.7 tptp -79.12 145.58 33.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.941 0.496 . . . . 0.0 110.063 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -77.22 -6.05 51.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.754 0.821 . . . . 0.0 111.586 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.486 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 26.7 t70 -59.45 -66.73 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.198 0.999 . . . . 0.0 111.052 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -32.46 73.84 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.297 0.998 . . . . 0.0 111.704 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -58.7 -57.32 13.54 Favored 'General case' 0 C--N 1.359 0.99 0 O-C-N 123.877 0.736 . . . . 0.0 110.368 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.82 -25.44 61.14 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.45 1.094 . . . . 0.0 111.386 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.81 -57.96 8.28 Favored 'General case' 0 C--N 1.354 0.779 0 C-N-CA 123.135 0.574 . . . . 0.0 110.156 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.26 -39.89 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.428 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -54.6 -59.1 5.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.021 0.928 . . . . 0.0 110.82 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 43.9 tp -67.73 -34.39 76.75 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.119 0.887 . . . . 0.0 111.398 -177.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.1 t -66.4 -30.16 70.48 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 122.381 0.272 . . . . 0.0 111.443 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 43.3 mt -83.48 -24.6 31.68 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.769 0.828 . . . . 0.0 110.96 175.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 87.2 mt -77.07 -19.67 56.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.186 0.594 . . . . 0.0 110.475 170.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -110.34 25.75 11.44 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.482 1.113 . . . . 0.0 109.947 176.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 p -54.85 120.79 30.78 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.555 0.742 . . . . 0.0 110.542 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.02 152.61 69.97 Favored 'Trans proline' 0 C--N 1.376 2.0 0 C-N-CA 122.969 2.446 . . . . 0.0 112.613 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -86.63 11.34 13.09 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.356 0.662 . . . . 0.0 110.111 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.48 HD12 ' HA ' ' A' ' 122' ' ' ASP . 5.6 tt -135.16 105.27 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.861 1.264 . . . . 0.0 108.468 175.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -107.75 -24.89 11.52 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.707 0.803 . . . . 0.0 109.749 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -152.65 72.38 0.97 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.321 1.048 . . . . 0.0 109.16 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 62.7 28.3 16.49 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.603 1.161 . . . . 0.0 112.276 176.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.91 -104.19 0.02 OUTLIER Glycine 0 C--N 1.359 1.827 0 CA-C-O 120.007 -0.329 . . . . 0.0 112.675 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -84.04 81.84 8.61 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.616 0.722 . . . . 0.0 109.059 175.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.48 ' HA ' HD12 ' A' ' 116' ' ' ILE . 31.6 t70 -62.01 -35.02 77.31 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.193 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.21 -22.23 66.87 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.378 0.671 . . . . 0.0 112.389 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -79.32 90.49 4.98 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -156.5 170.08 23.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.678 1.191 . . . . 0.0 108.855 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 43.2 tpp -150.08 128.21 11.97 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.165 0.586 . . . . 0.0 110.264 -177.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -129.56 105.91 8.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.279 1.031 . . . . 0.0 108.577 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.45 -165.85 2.33 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.1 0.96 . . . . 0.0 109.684 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.46 75.0 4.02 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.322 0.649 . . . . 0.0 111.879 -177.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.2 t -104.32 90.01 3.42 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 121.657 0.741 . . . . 0.0 109.143 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.4 t -165.08 154.94 13.26 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.396 0.678 . . . . 0.0 109.759 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 C-N-CA 123.785 0.834 . . . . 0.0 109.152 178.155 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 110.657 -0.127 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.0 tpt -52.61 -52.39 55.58 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.22 1.008 . . . . 0.0 111.951 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.504 HD13 ' HG ' ' A' ' 44' ' ' LEU . 2.5 pt? -62.54 -33.54 75.13 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.995 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.2 -49.45 71.95 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.164 0.586 . . . . 0.0 109.938 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -69.3 -42.33 75.59 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.73 -174.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -56.26 -54.34 46.49 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.364 1.065 . . . . 0.0 110.727 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 40' ' ' LEU . 15.2 tp -65.08 -42.2 94.34 Favored 'General case' 0 C--N 1.357 0.922 0 O-C-N 123.496 0.498 . . . . 0.0 111.285 -177.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -57.29 -37.63 72.71 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.209 1.004 . . . . 0.0 111.4 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.45 -48.37 56.27 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.336 0.654 . . . . 0.0 111.161 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 17.7 pt -82.51 -16.18 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 74.9 p -96.05 -48.01 5.86 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.111 0.481 . . . . 0.0 109.874 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -9.87 47.33 Favored Glycine 0 N--CA 1.468 0.816 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.026 -173.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.419 HD12 ' HB3' ' A' ' 58' ' ' LEU . 88.1 mt -75.85 112.11 13.11 Favored 'Isoleucine or valine' 0 C--N 1.348 0.538 0 C-N-CA 124.202 1.001 . . . . 0.0 110.351 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -79.49 -14.92 58.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 9.4 t70 -78.17 116.33 58.03 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.07 0.948 . . . . 0.0 110.336 -175.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.01 -23.43 34.21 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.924 2.416 . . . . 0.0 113.456 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.0 m -62.31 -50.15 72.77 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.073 0.549 . . . . 0.0 110.061 -177.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.8 -38.36 78.42 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 125.112 1.507 . . . . 0.0 111.318 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.507 ' HA ' HD22 ' A' ' 28' ' ' LEU . 43.1 mt -67.67 -46.55 72.03 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.199 0.937 . . . . 0.0 111.111 -176.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -62.27 -46.06 90.49 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.667 0.604 . . . . 0.0 111.022 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.498 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 47.2 mt-10 -65.15 -31.2 72.27 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.497 0.719 . . . . 0.0 112.16 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -43.81 64.58 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.676 0.61 . . . . 0.0 110.43 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.504 ' HG ' HD13 ' A' ' 24' ' ' LEU . 4.2 mm? -68.58 -27.05 65.72 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 0.0 110.349 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.7 tmmm? -75.38 -45.2 40.62 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.255 1.022 . . . . 0.0 110.309 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.22 -30.29 68.42 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.443 0.697 . . . . 0.0 111.274 -177.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.08 2.79 56.06 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.724 0.81 . . . . 0.0 112.123 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 67.65 11.74 8.52 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.842 1.257 . . . . 0.0 111.866 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.05 2.25 22.08 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 123.537 0.589 . . . . 0.0 113.55 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -88.17 110.26 20.55 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.352 0.596 . . . . 0.0 110.666 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.4 tt -67.99 -18.94 24.22 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.798 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 m -71.08 -50.55 32.54 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.456 0.703 . . . . 0.0 111.008 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -64.66 -38.64 91.69 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.903 174.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.68 62.59 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.127 0.892 . . . . 0.0 112.527 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -65.06 -41.15 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 O-C-N 123.583 0.552 . . . . 0.0 110.888 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.8 t -59.41 -42.7 92.4 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.612 0.57 . . . . 0.0 111.227 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 85.9 mt -71.18 -38.14 72.14 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.049 0.54 . . . . 0.0 111.559 -177.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.419 ' HB3' HD12 ' A' ' 34' ' ' ILE . 37.8 mt -76.78 -26.43 54.49 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.8 p -85.05 -40.65 16.58 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.163 0.438 . . . . 0.0 110.877 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.46 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . 61.9 m-20 -77.62 19.69 0.36 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.32 -20.92 63.88 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-O 120.986 0.422 . . . . 0.0 109.996 160.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' A' ' 60' ' ' ASP . 30.3 ptt180 -58.94 -36.19 74.37 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 125.186 1.394 . . . . 0.0 111.874 171.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.1 p -102.81 15.88 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.684 0.793 . . . . 0.0 110.881 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -62.28 105.82 0.66 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.444 0.697 . . . . 0.0 109.829 170.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -52.22 135.99 40.12 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 125.053 1.341 . . . . 0.0 112.513 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -82.82 113.98 3.11 Favored 'Cis proline' 0 C--N 1.381 2.246 0 C-N-CA 124.566 -1.014 . . . . 0.0 111.291 -1.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 56.4 p -100.25 -87.37 0.37 Allowed 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -178.83 164.71 1.55 Allowed 'General case' 0 C--O 1.246 0.916 0 C-N-CA 124.168 0.987 . . . . 0.0 110.147 -171.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.26 133.17 36.71 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 168.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.9 p -93.49 93.42 8.1 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.306 0.643 . . . . 0.0 111.121 -173.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.1 m -82.45 147.22 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.383 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.93 76.34 9.77 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.2 m -152.87 154.96 36.16 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 124.426 1.091 . . . . 0.0 109.123 -173.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -66.52 128.65 93.96 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 122.987 0.515 . . . . 0.0 109.674 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -69.95 151.79 68.1 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 122.66 2.24 . . . . 0.0 112.147 174.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.7 t -77.26 168.88 19.31 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.195 0.598 . . . . 0.0 110.148 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -69.52 87.83 0.48 Allowed 'General case' 0 C--N 1.349 0.576 0 C-N-CA 123.292 0.637 . . . . 0.0 110.991 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.1 p -113.19 107.41 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.546 1.138 . . . . 0.0 109.398 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -103.27 139.11 39.15 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.884 0.874 . . . . 0.0 108.947 178.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.49 31.33 3.77 Favored Glycine 0 C--N 1.347 1.158 0 O-C-N 123.478 0.486 . . . . 0.0 112.942 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -66.49 90.23 0.16 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.606 0.763 . . . . 0.0 110.8 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.37 -2.06 43.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.199 1.0 . . . . 0.0 111.038 177.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.73 144.26 51.0 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.735 0.814 . . . . 0.0 111.229 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -90.66 37.44 0.92 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.676 0.791 . . . . 0.0 110.33 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -64.46 146.05 55.14 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 123.943 0.897 . . . . 0.0 110.234 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -61.98 104.07 0.42 Allowed 'General case' 0 C--O 1.245 0.862 0 O-C-N 123.833 0.708 . . . . 0.0 109.423 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 27.1 m -73.95 142.92 14.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.715 177.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.37 15.78 19.1 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.731 0.813 . . . . 0.0 109.761 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.07 165.25 9.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.396 1.078 . . . . 0.0 112.715 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.432 ' HD3' ' N ' ' A' ' 90' ' ' LYS . 0.1 OUTLIER -51.51 148.51 5.11 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.225 1.01 . . . . 0.0 111.822 175.802 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.3 m -121.85 23.87 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 CA-C-O 121.967 0.889 . . . . 0.0 110.009 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.486 HG13 ' H ' ' A' ' 129' ' ' ALA . 40.7 mm -105.95 80.15 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.114 -171.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -124.93 147.27 48.94 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.937 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -144.23 16.76 1.71 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.531 0.733 . . . . 0.0 110.895 -173.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.3 p -78.22 -167.12 0.95 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.919 0.39 . . . . 0.0 110.949 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -82.16 10.32 7.0 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.7 121.71 18.46 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 123.015 0.526 . . . . 0.0 110.571 175.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -85.73 165.92 16.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.372 0.669 . . . . 0.0 111.017 178.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.5 ' HE3' ' HB2' ' A' ' 101' ' ' ASP . 58.6 tttp -164.06 149.03 10.34 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.665 1.186 . . . . 0.0 107.993 -172.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -98.15 -20.67 17.16 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 122.485 0.314 . . . . 0.0 111.492 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.5 ' HB2' ' HE3' ' A' ' 99' ' ' LYS . 4.7 m-20 -65.23 -47.09 78.03 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.17 0.588 . . . . 0.0 112.185 -173.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -32.15 72.44 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.437 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -66.15 -44.85 82.94 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.94 0.496 . . . . 0.0 110.393 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.96 90.54 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.011 0.819 . . . . 0.0 110.677 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -57.76 11.33 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.206 1.003 . . . . 0.0 111.83 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.2 mm -64.47 -42.18 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.926 0.891 . . . . 0.0 111.188 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.78 88.65 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.342 0.657 . . . . 0.0 111.528 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.01 -45.65 80.77 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -67.69 -27.78 67.12 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.614 0.765 . . . . 0.0 111.908 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.9 tt -81.14 -45.85 15.8 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.85 0.86 . . . . 0.0 109.889 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.4 tt -88.6 -59.35 2.26 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.311 0.645 . . . . 0.0 109.319 -172.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -80.28 164.6 23.07 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.116 0.566 . . . . 0.0 109.74 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.0 m -80.37 118.69 73.61 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 123.22 0.608 . . . . 0.0 109.511 174.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.36 157.52 60.87 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.023 2.482 . . . . 0.0 110.972 173.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.519 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 11.0 mmpt? -84.07 80.87 9.03 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.552 0.692 . . . . 0.0 109.983 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.429 HG12 ' HB2' ' A' ' 121' ' ' ARG . 22.4 mt -134.59 63.63 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -87.35 -45.26 10.73 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 121.297 0.57 . . . . 0.0 109.773 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -148.5 14.38 0.97 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.771 1.229 . . . . 0.0 108.937 175.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -80.39 -41.88 23.83 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 124.671 1.188 . . . . 0.0 110.364 -175.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.46 38.04 79.4 Favored Glycine 0 C--N 1.348 1.197 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.731 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.429 ' HB2' HG12 ' A' ' 116' ' ' ILE . 78.8 mtp180 -86.55 7.33 26.63 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.474 0.71 . . . . 0.0 111.248 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.21 -36.06 83.02 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.939 0.896 . . . . 0.0 111.937 -178.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 4.8 tt -126.58 107.44 10.22 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -127.25 101.88 6.68 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 176.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -67.71 119.6 12.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.361 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -67.41 108.86 2.95 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 34.9 p-80 -61.1 139.57 58.06 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.963 0.505 . . . . 0.0 110.863 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.09 146.72 45.57 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.554 0.693 . . . . 0.0 111.252 -176.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.486 ' H ' HG13 ' A' ' 92' ' ' ILE . . . -126.2 46.08 2.51 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 168.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 54.7 m -52.99 97.23 0.02 OUTLIER 'General case' 0 C--N 1.365 1.266 0 CA-C-N 113.989 -1.459 . . . . 0.0 112.101 -174.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 30.7 m -77.55 78.65 4.06 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.745 0.818 . . . . 0.0 109.707 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 C-N-CA 123.702 0.801 . . . . 0.0 108.989 178.775 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 . . . . . 0 N--CA 1.483 1.195 0 CA-C-O 119.316 -0.373 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.1 ttt -51.55 -51.99 50.82 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.826 0.851 . . . . 0.0 111.935 -175.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.588 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -52.48 -39.86 61.68 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.466 0.707 . . . . 0.0 112.605 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.588 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.1 mm? -62.55 -51.99 65.18 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -60.14 -46.28 90.18 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.553 1.158 . . . . 0.0 111.809 -174.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -62.26 -55.86 24.24 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 124.138 0.899 . . . . 0.0 110.596 -178.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.573 HD21 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -62.38 -49.44 75.54 Favored 'General case' 0 C--N 1.356 0.865 0 O-C-N 123.806 0.691 . . . . 0.0 111.019 -176.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -57.27 -34.4 68.61 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.648 1.179 . . . . 0.0 111.493 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.76 -54.07 26.57 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.558 175.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.0 pt -88.5 -6.47 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -167.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 p -105.49 -40.11 5.9 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.306 0.643 . . . . 0.0 109.535 171.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.72 1.8 67.78 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.982 -176.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.508 HD11 HD11 ' A' ' 58' ' ' LEU . 67.1 mt -78.98 122.21 33.74 Favored 'Isoleucine or valine' 0 C--N 1.348 0.516 0 C-N-CA 123.939 0.896 . . . . 0.0 111.262 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -83.05 -21.0 33.92 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.985 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 10.5 m-20 -66.87 109.13 3.03 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 123.793 0.837 . . . . 0.0 110.061 -177.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -69.17 -29.54 26.51 Favored 'Trans proline' 0 C--N 1.373 1.85 0 C-N-CA 122.512 2.142 . . . . 0.0 111.763 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 m -61.4 -43.07 99.5 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.284 0.634 . . . . 0.0 109.909 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -60.73 -39.15 87.58 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 123.404 0.44 . . . . 0.0 110.36 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.573 ' HA ' HD21 ' A' ' 28' ' ' LEU . 62.0 mt -67.72 -52.85 32.82 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 124.19 0.931 . . . . 0.0 111.499 -175.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -62.36 -49.73 74.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.697 0.399 . . . . 0.0 111.54 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -65.33 -26.77 68.19 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.978 0.511 . . . . 0.0 111.878 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.23 -45.24 70.28 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.618 0.367 . . . . 0.0 110.502 171.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.438 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -66.31 -23.15 66.33 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.555 0.742 . . . . 0.0 111.091 175.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mpmm? -75.62 -45.37 37.81 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.363 0.665 . . . . 0.0 109.425 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -12.88 61.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.861 0.864 . . . . 0.0 112.048 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 98.5 p -110.44 -4.68 15.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.366 0.667 . . . . 0.0 111.725 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 65.05 20.88 12.17 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.551 1.14 . . . . 0.0 112.08 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.88 2.57 32.08 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-O 119.543 -0.587 . . . . 0.0 113.318 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -89.42 115.63 27.01 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.009 0.523 . . . . 0.0 110.305 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.545 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.6 tp -62.38 -39.13 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.468 0.307 . . . . 0.0 111.774 -173.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.1 m -66.05 -47.66 73.64 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.795 0.838 . . . . 0.0 110.89 -172.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -65.44 -36.79 84.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.239 0.615 . . . . 0.0 110.858 177.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -44.75 87.06 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 123.586 0.554 . . . . 0.0 111.336 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 51' ' ' ILE . 38.9 t -62.1 -49.3 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.866 177.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 m -54.55 -45.84 73.52 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.136 0.974 . . . . 0.0 111.762 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -71.49 -34.19 69.92 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.124 -175.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.508 HD11 HD11 ' A' ' 34' ' ' ILE . 62.8 mt -72.77 -45.52 58.19 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 175.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.1 p -70.88 -12.31 61.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.481 0.713 . . . . 0.0 112.012 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.479 ' HA ' ' HB ' ' A' ' 63' ' ' VAL . 27.2 t70 -58.7 -18.83 34.55 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.712 0.805 . . . . 0.0 111.866 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -51.09 -35.56 35.66 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.41 1.084 . . . . 0.0 112.517 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -109.89 -19.61 13.05 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.081 0.953 . . . . 0.0 111.223 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.479 ' HB ' ' HA ' ' A' ' 60' ' ' ASP . 97.6 t -79.19 -28.94 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.069 0.547 . . . . 0.0 111.518 -176.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -64.64 101.65 0.49 Allowed 'General case' 0 CA--C 1.562 1.436 0 CA-C-O 122.098 0.951 . . . . 0.0 110.197 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.19 141.89 58.5 Favored Pre-proline 0 CA--C 1.563 1.459 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.407 -178.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -85.88 117.0 4.13 Favored 'Cis proline' 0 C--N 1.378 2.1 0 C-N-CA 124.451 -1.062 . . . . 0.0 111.831 -6.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -63.35 -50.01 71.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.554 0.741 . . . . 0.0 110.347 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -116.52 169.56 9.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.402 177.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -67.21 -46.39 73.98 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.158 0.504 . . . . 0.0 110.098 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 p -87.92 114.3 24.4 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.792 175.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 33.8 m -77.89 -176.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 122.904 0.481 . . . . 0.0 109.994 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.48 38.06 0.6 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.362 0.665 . . . . 0.0 111.88 -177.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.5 m 56.19 26.47 10.35 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.825 1.25 . . . . 0.0 111.009 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -84.64 151.38 58.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.739 -170.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.6 157.65 48.37 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.23 1.954 . . . . 0.0 111.292 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.3 m -127.67 82.12 2.07 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.419 0.688 . . . . 0.0 110.42 -175.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -108.84 66.34 0.63 Allowed 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.495 1.14 . . . . 0.0 108.954 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.0 t -77.07 130.8 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.198 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -60.31 110.21 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.783 0.677 . . . . 0.0 110.647 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 164.62 51.55 0.02 OUTLIER Glycine 0 C--N 1.336 0.573 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.896 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 56.3 m -62.31 94.71 0.06 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.164 0.586 . . . . 0.0 110.424 175.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.64 -33.55 69.0 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.926 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -77.59 147.1 35.83 Favored 'General case' 0 C--O 1.243 0.763 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.351 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -64.15 115.31 4.86 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -158.28 86.82 0.89 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.325 0.583 . . . . 0.0 110.165 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.91 -177.75 3.46 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.613 173.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 m -75.21 177.85 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 123.41 0.684 . . . . 0.0 110.485 172.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -81.77 59.28 4.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 110.349 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.5 112.62 24.39 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.65 0.78 . . . . 0.0 110.094 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.451 ' HD3' ' N ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -158.53 153.25 24.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.2 t -108.72 26.31 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 122.623 1.202 . . . . 0.0 109.119 177.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 42.8 mm -109.27 75.45 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -158.51 22.04 0.23 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.956 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 pp -86.85 63.85 8.18 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 122.305 1.05 . . . . 0.0 109.235 177.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.4 p -71.25 150.47 45.2 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.275 -1.33 . . . . 0.0 110.816 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 71.49 9.68 6.45 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 124.891 1.276 . . . . 0.0 111.163 -178.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -82.77 126.85 32.86 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.748 0.819 . . . . 0.0 109.717 175.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -158.57 153.13 24.47 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.952 0.901 . . . . 0.0 109.262 178.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.601 ' HD2' ' HB3' ' A' ' 101' ' ' ASP . 2.7 ttmp? -96.94 160.04 14.57 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -98.08 14.28 28.06 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.287 0.635 . . . . 0.0 111.455 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.601 ' HB3' ' HD2' ' A' ' 99' ' ' LYS . 8.0 p-10 -70.51 -43.93 68.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.996 0.518 . . . . 0.0 112.015 -170.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -26.87 61.57 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.757 -178.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -64.68 -44.59 89.86 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.496 0.318 . . . . 0.0 110.323 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.39 91.45 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.665 0.603 . . . . 0.0 111.211 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.22 75.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.761 0.824 . . . . 0.0 111.965 -177.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 43.9 mm -68.39 -38.97 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 110.764 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.27 97.27 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.962 0.505 . . . . 0.0 111.187 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.82 -45.8 87.97 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.605 176.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.7 t -66.37 -26.9 67.48 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.044 0.937 . . . . 0.0 111.798 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -80.58 -44.91 18.2 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.299 0.64 . . . . 0.0 109.799 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.8 mp -80.15 -62.98 1.51 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.857 0.463 . . . . 0.0 110.308 -176.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -101.11 177.38 4.96 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.9 p -136.43 148.85 65.7 Favored Pre-proline 0 CA--C 1.543 0.692 0 C-N-CA 123.59 0.756 . . . . 0.0 109.052 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -56.9 126.97 23.95 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.981 2.454 . . . . 0.0 112.609 -176.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -68.49 -15.93 63.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.611 0.765 . . . . 0.0 111.233 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.421 ' HA ' ' HA ' ' A' ' 122' ' ' ASP . 58.7 mt -61.48 106.02 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 123.087 0.555 . . . . 0.0 109.54 171.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.87 -20.28 42.63 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.696 0.799 . . . . 0.0 111.649 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -105.53 -163.76 0.97 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.846 0.858 . . . . 0.0 110.905 -178.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -65.97 -35.12 79.72 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.209 0.604 . . . . 0.0 110.817 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -161.38 16.67 0.17 Allowed Glycine 0 C--N 1.346 1.084 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.942 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -112.17 118.04 34.25 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.421 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 5.1 p-10 -91.26 16.81 9.25 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.637 0.775 . . . . 0.0 110.651 168.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.5 mp -73.26 77.17 1.32 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.178 0.991 . . . . 0.0 109.662 178.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -84.89 99.14 10.74 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.729 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -84.01 93.73 8.14 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.691 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -131.97 -59.8 0.93 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.812 0.845 . . . . 0.0 108.896 -179.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 44.0 t60 -124.97 106.91 10.32 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 174.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -131.67 168.49 17.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.282 1.033 . . . . 0.0 108.901 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.72 93.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.308 0.643 . . . . 0.0 110.237 170.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 33.4 p -71.9 96.26 1.66 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.238 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 47.0 t -58.85 122.31 13.3 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.246 1.018 . . . . 0.0 111.454 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 0.983 0 C-N-CA 123.571 0.749 . . . . 0.0 110.432 179.98 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -57.23 -34.44 68.57 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.694 0.797 . . . . 0.0 112.109 -174.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.557 ' HG ' HD21 ' A' ' 25' ' ' LEU . 2.1 pt? -59.15 -41.71 88.97 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.2 0.6 . . . . 0.0 112.178 177.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.557 HD21 ' HG ' ' A' ' 24' ' ' LEU . 2.7 mm? -72.78 -44.91 60.98 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.104 0.161 . . . . 0.0 110.657 177.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -59.27 -51.12 71.31 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 124.071 0.857 . . . . 0.0 111.124 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -66.37 -46.98 74.85 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.11 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.472 HD21 ' CD2' ' A' ' 44' ' ' LEU . 19.0 tp -56.19 -49.99 72.5 Favored 'General case' 0 C--N 1.368 1.382 0 O-C-N 123.647 0.592 . . . . 0.0 110.428 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.42 ' NH2' HE22 ' A' ' 35' ' ' GLN . 66.1 ttt180 -54.43 -40.44 68.33 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.797 1.239 . . . . 0.0 111.546 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.89 -46.74 73.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.917 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 pt -93.38 1.59 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -170.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 HD12 ' A' ' 58' ' ' LEU . 68.6 p -117.83 -41.11 2.94 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.089 0.556 . . . . 0.0 110.363 171.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.85 2.47 55.12 Favored Glycine 0 N--CA 1.469 0.89 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.006 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.615 HD12 HD11 ' A' ' 58' ' ' LEU . 67.6 mt -82.15 115.55 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 110.937 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.42 HE22 ' NH2' ' A' ' 29' ' ' ARG . 16.6 mm100 -79.65 -20.52 46.52 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.665 1.186 . . . . 0.0 111.793 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.99 108.02 3.26 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 123.517 0.727 . . . . 0.0 109.823 176.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.0 -27.2 50.45 Favored 'Trans proline' 0 C--N 1.385 2.46 0 C-N-CA 122.603 2.202 . . . . 0.0 111.137 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -58.05 -51.23 70.54 Favored 'General case' 0 C--N 1.352 0.717 0 C-N-CA 124.12 0.968 . . . . 0.0 111.19 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.463 ' CD2' HD11 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -62.49 -28.9 70.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.112 0.965 . . . . 0.0 110.664 -179.058 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.1 mt -73.2 -54.82 7.49 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.623 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -57.55 -38.09 74.17 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.397 0.679 . . . . 0.0 111.55 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -69.03 -37.04 78.38 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.535 0.734 . . . . 0.0 111.829 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.411 ' HB1' HD21 ' A' ' 58' ' ' LEU . . . -62.5 -47.77 82.49 Favored 'General case' 0 C--O 1.241 0.608 0 O-C-N 123.366 0.416 . . . . 0.0 110.868 172.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.1 mm? -64.67 -35.6 81.56 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.563 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -75.43 -36.53 60.77 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.89 -33.82 74.4 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.463 0.705 . . . . 0.0 110.616 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 m -91.1 3.14 55.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.295 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 65.55 12.05 7.91 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.141 1.377 . . . . 0.0 113.099 173.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.4 -11.56 7.16 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 119.518 -0.601 . . . . 0.0 112.624 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -79.64 108.24 13.02 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 117.401 0.601 . . . . 0.0 109.999 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.494 ' O ' HG22 ' A' ' 55' ' ' VAL . 16.2 tt -67.85 -31.34 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.969 -175.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 23.9 m -70.97 -43.39 68.18 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.039 0.536 . . . . 0.0 110.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -68.04 -32.05 72.14 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.207 175.32 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.96 93.78 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.386 0.675 . . . . 0.0 110.978 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 51' ' ' ILE . 40.0 t -60.81 -46.4 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 123.69 0.619 . . . . 0.0 109.698 174.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.6 m -55.82 -39.18 71.02 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.567 0.747 . . . . 0.0 112.158 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.75 -40.28 63.61 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.326 0.651 . . . . 0.0 111.741 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.615 HD11 HD12 ' A' ' 34' ' ' ILE . 88.6 mt -68.69 -46.29 69.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.528 0.331 . . . . 0.0 111.878 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.6 p -63.84 -25.52 68.21 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 124.096 0.873 . . . . 0.0 111.198 -178.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.71 -64.65 0.81 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.34 171.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -65.8 -25.38 67.21 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -168.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.09 -8.53 57.63 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 122.98 0.512 . . . . 0.0 112.008 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.7 18.16 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.469 0 C-N-CA 123.386 0.675 . . . . 0.0 109.743 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.8 tttp -77.64 93.89 4.3 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.243 0.617 . . . . 0.0 110.973 -173.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -96.51 152.78 38.84 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.515 0.726 . . . . 0.0 110.254 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.48 118.27 5.49 Favored 'Cis proline' 0 C--N 1.385 2.449 0 CA-C-N 120.417 1.185 . . . . 0.0 113.885 3.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.7 t -130.21 110.36 11.51 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.782 1.233 . . . . 0.0 107.881 173.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -105.58 27.67 8.18 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 122.308 1.052 . . . . 0.0 109.047 177.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -84.38 58.17 4.69 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.408 1.083 . . . . 0.0 109.042 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -80.15 139.5 36.78 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.848 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.0 t -98.42 102.32 13.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 -24.19 34.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.387 0.675 . . . . 0.0 111.539 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 t -77.53 156.34 31.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.006 0.523 . . . . 0.0 110.83 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.62 143.12 31.54 Favored Pre-proline 0 CA--C 1.554 1.11 0 C-N-CA 124.063 0.945 . . . . 0.0 110.624 -177.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.76 117.23 3.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 123.324 2.683 . . . . 0.0 111.668 168.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.8 p -105.37 6.51 32.68 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.694 0.797 . . . . 0.0 111.256 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -75.49 82.83 2.55 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.249 1.02 . . . . 0.0 110.153 -171.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.4 m -110.98 154.15 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.498 1.119 . . . . 0.0 109.339 176.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -75.38 -49.35 19.29 Favored 'General case' 0 C--O 1.243 0.713 0 C-N-CA 123.15 0.58 . . . . 0.0 110.375 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 132.1 -36.47 2.2 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.412 -176.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.9 m -104.04 173.79 6.15 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.473 0.709 . . . . 0.0 110.862 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.24 63.72 7.32 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.444 1.097 . . . . 0.0 109.675 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -99.86 -145.48 0.33 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.294 1.038 . . . . 0.0 109.833 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -73.86 70.02 1.42 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.436 1.112 . . . . 0.0 110.844 174.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -100.3 137.92 38.07 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.88 1.272 . . . . 0.0 108.457 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -64.25 108.96 1.72 Allowed 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 169.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.0 m -64.57 142.51 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 112.304 -169.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 tt -97.16 81.26 3.02 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.82 43.56 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.658 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.428 ' HE3' ' N ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -64.18 147.93 51.18 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.422 0.63 . . . . 0.0 110.495 176.481 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 16.1 m -123.99 38.38 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.481 1.112 . . . . 0.0 108.419 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 42.8 mm 61.18 83.81 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.912 0 C-N-CA 125.18 1.392 . . . . 0.0 109.123 -168.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -139.91 139.85 36.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.632 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.31 -29.7 2.96 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.607 0.763 . . . . 0.0 109.651 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 t -60.62 133.2 55.86 Favored 'General case' 0 C--N 1.354 0.776 0 CA-C-O 121.716 0.769 . . . . 0.0 111.707 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -100.82 12.08 38.28 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.047 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.55 -29.94 71.13 Favored 'General case' 0 C--N 1.362 1.121 0 C-N-CA 124.044 0.938 . . . . 0.0 110.705 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -55.71 147.21 19.12 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.574 0.75 . . . . 0.0 110.138 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.649 ' HD3' ' HB2' ' A' ' 101' ' ' ASP . 0.1 OUTLIER -64.42 151.88 42.99 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 121.033 0.444 . . . . 0.0 109.919 172.72 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -91.27 -9.25 45.8 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.527 0.731 . . . . 0.0 110.291 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . 0.649 ' HB2' ' HD3' ' A' ' 99' ' ' LYS . 7.5 m-20 -59.43 -47.86 83.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.648 0.779 . . . . 0.0 112.259 -173.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.571 HD12 ' HG3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -68.54 -33.18 73.65 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.231 0.332 . . . . 0.0 110.337 179.097 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -72.16 -29.54 64.13 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.642 0.777 . . . . 0.0 111.284 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.15 -44.83 59.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.799 0.84 . . . . 0.0 109.474 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.89 73.19 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.609 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.8 mm -71.04 -40.35 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.457 0.703 . . . . 0.0 111.193 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.469 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -60.7 -42.01 96.35 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.387 0.429 . . . . 0.0 110.617 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.36 -50.48 67.54 Favored 'General case' 0 C--N 1.353 0.745 0 O-C-N 123.815 0.697 . . . . 0.0 109.71 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -63.8 -29.85 71.0 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.556 0.742 . . . . 0.0 111.211 -178.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.42 -42.61 71.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.934 0.894 . . . . 0.0 110.561 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 74.7 mt -74.17 -26.82 60.51 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.122 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -93.05 1.63 57.16 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.502 0.721 . . . . 0.0 110.918 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.2 m -57.77 142.19 78.79 Favored Pre-proline 0 C--N 1.359 0.992 0 C-N-CA 123.081 0.552 . . . . 0.0 110.509 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.45 151.08 82.09 Favored 'Trans proline' 0 C--N 1.38 2.2 0 C-N-CA 122.79 2.326 . . . . 0.0 112.288 -173.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -5.69 5.47 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.07 0.948 . . . . 0.0 112.606 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 22.5 mt -59.71 -23.19 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.879 1.272 . . . . 0.0 111.834 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -60.31 -27.74 67.56 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.335 1.054 . . . . 0.0 111.846 175.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -121.86 -72.2 0.7 Allowed 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.755 0.822 . . . . 0.0 110.166 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -132.73 79.94 1.87 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.904 0.882 . . . . 0.0 110.616 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -156.82 8.49 0.24 Allowed Glycine 0 CA--C 1.535 1.287 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.631 171.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -51.66 97.05 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.036 1.334 . . . . 0.0 111.249 172.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -79.69 -50.12 11.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.772 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 5.2 mp -83.19 83.74 7.74 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.236 0.614 . . . . 0.0 109.864 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -86.56 -40.29 15.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 172.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.71 132.62 56.36 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 163.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.447 ' N ' ' SD ' ' A' ' 126' ' ' MET . 2.8 mpp? -97.75 -67.4 0.85 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 59.1 m80 -147.82 138.43 23.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.387 1.075 . . . . 0.0 109.572 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 110.2 11.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 173.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.64 -67.16 0.58 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.517 0.727 . . . . 0.0 111.227 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 1.4 p -159.17 107.76 1.85 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.188 1.395 . . . . 0.0 108.147 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.2 t -67.4 -20.46 65.54 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.361 0.665 . . . . 0.0 112.269 -176.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.248 0 C-N-CA 123.577 0.751 . . . . 0.0 109.169 176.349 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.377 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.5 ttt -49.02 -46.81 44.64 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.912 0.885 . . . . 0.0 113.359 -168.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.414 HD11 ' HG ' ' A' ' 44' ' ' LEU . 1.8 pt? -51.83 -44.95 63.78 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.685 0.794 . . . . 0.0 111.85 175.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.43 -38.63 81.37 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.019 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.37 -53.72 44.25 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 123.634 0.584 . . . . 0.0 110.376 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -50.04 -56.46 10.67 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 124.516 1.135 . . . . 0.0 109.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.554 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.4 tp -57.7 -50.16 74.12 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 124.799 1.312 . . . . 0.0 111.166 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -57.26 -39.24 75.2 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.655 1.182 . . . . 0.0 112.489 -175.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.43 -37.02 52.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.303 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 pt -90.11 -14.11 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 80.2 p -102.96 -31.18 10.36 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.288 0.635 . . . . 0.0 110.409 173.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.11 -7.43 76.17 Favored Glycine 0 N--CA 1.47 0.917 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.963 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.471 HD11 HD11 ' A' ' 58' ' ' LEU . 84.6 mt -80.04 117.35 25.72 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 C-N-CA 124.004 0.921 . . . . 0.0 110.993 -173.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -82.35 -25.82 33.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.749 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.426 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 6.7 m-20 -58.92 109.35 1.81 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 124.081 0.952 . . . . 0.0 111.13 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.84 -23.13 48.22 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.113 2.542 . . . . 0.0 111.977 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.2 m -56.91 -52.13 66.39 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.971 0.908 . . . . 0.0 109.933 174.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.35 -38.51 91.45 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.784 0.834 . . . . 0.0 110.897 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.554 ' HA ' HD23 ' A' ' 28' ' ' LEU . 73.8 mt -69.63 -55.49 9.9 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.261 0.976 . . . . 0.0 111.437 -173.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -63.96 -42.41 97.29 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.252 0.621 . . . . 0.0 111.769 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.49 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 45.2 mt-10 -72.52 -29.41 63.57 Favored 'General case' 0 C--N 1.351 0.647 0 C-N-CA 122.876 0.47 . . . . 0.0 111.881 -176.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.15 74.7 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 117.838 0.29 . . . . 0.0 110.407 172.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.437 ' CD2' HD21 ' A' ' 28' ' ' LEU . 3.0 mm? -67.79 -32.72 73.48 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.794 0.838 . . . . 0.0 110.891 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.49 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.2 tmmm? -71.53 -44.9 63.77 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.921 0.888 . . . . 0.0 110.238 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.57 -30.47 67.18 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.729 0.812 . . . . 0.0 111.447 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.3 p -85.68 0.48 52.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.448 0.699 . . . . 0.0 112.135 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 64.5 25.75 13.3 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 122.08 0.943 . . . . 0.0 110.491 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.1 65.12 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.456 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -74.58 108.51 7.38 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.542 ' O ' HG21 ' A' ' 55' ' ' VAL . 7.0 tp -55.73 -44.68 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.478 0.486 . . . . 0.0 111.784 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.5 m -66.28 -39.37 89.35 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.842 0.857 . . . . 0.0 111.329 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.478 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 mm-40 -62.9 -43.32 99.12 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 122.976 0.51 . . . . 0.0 110.029 173.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.57 -41.08 93.88 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 124.082 0.864 . . . . 0.0 111.614 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.542 HG21 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -58.86 -49.86 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.299 173.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.1 t -61.75 -31.29 71.46 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.077 0.861 . . . . 0.0 111.788 -178.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.8 mt -73.24 -33.93 65.59 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.471 HD11 HD11 ' A' ' 34' ' ' ILE . 80.2 mt -89.3 -17.54 28.75 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.4 p -96.91 -14.91 21.46 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.046 0.384 . . . . 0.0 111.867 -178.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -76.87 -20.38 56.35 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 171.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.49 -47.26 84.73 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 124.588 1.155 . . . . 0.0 111.666 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -72.08 -14.81 61.95 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.143 0.577 . . . . 0.0 112.383 -174.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 p -116.04 3.31 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.848 0.859 . . . . 0.0 109.961 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -72.08 97.8 1.98 Allowed 'General case' 0 C--N 1.348 0.533 0 C-N-CA 123.515 0.726 . . . . 0.0 110.118 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.08 138.19 73.04 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.95 0.9 . . . . 0.0 112.611 -175.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -83.71 115.26 3.52 Favored 'Cis proline' 0 C--N 1.378 2.086 0 C-N-CA 124.311 -1.121 . . . . 0.0 112.931 -3.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 67.8 m -100.14 57.63 0.97 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 173.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -73.73 103.15 4.19 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -75.82 74.31 2.76 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.379 1.072 . . . . 0.0 110.118 -174.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 42.5 p -86.08 109.12 18.61 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.861 0.864 . . . . 0.0 109.95 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 5.9 p -130.7 96.03 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-O 122.151 0.977 . . . . 0.0 110.908 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.71 -4.37 53.29 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.984 167.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.8 m -71.3 114.04 8.96 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.74 130.68 85.1 Favored Pre-proline 0 CA--C 1.557 1.224 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 170.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.99 110.5 1.16 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 122.956 2.437 . . . . 0.0 111.772 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.9 p -72.68 77.6 1.1 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.154 0.982 . . . . 0.0 110.859 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -88.21 -41.22 13.1 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.491 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 44.1 t 74.45 -20.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 C-N-CA 125.508 1.523 . . . . 0.0 112.366 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.69 101.11 0.76 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.117 0.967 . . . . 0.0 111.318 -172.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -82.45 -59.78 2.2 Favored Glycine 0 C--N 1.345 1.035 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 174.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 46.9 m 54.1 36.03 23.74 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.826 1.25 . . . . 0.0 111.806 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.3 55.92 3.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.598 0.759 . . . . 0.0 109.624 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.71 83.66 7.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.28 -176.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -97.78 -13.34 21.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.424 175.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -66.8 104.75 1.4 Allowed 'General case' 0 C--N 1.357 0.904 0 C-N-CA 123.175 0.59 . . . . 0.0 109.725 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.63 157.62 43.41 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 123.557 0.743 . . . . 0.0 109.365 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 30.9 m -83.51 122.03 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.5 mt -88.25 63.62 7.26 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 122.053 0.93 . . . . 0.0 108.713 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.47 -174.18 2.41 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.432 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -142.17 141.15 32.58 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.5 p -107.12 18.34 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 122.434 1.112 . . . . 0.0 110.008 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 29.6 mm -98.94 8.45 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.282 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -85.78 57.66 4.6 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.935 0.894 . . . . 0.0 110.756 -179.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -60.42 -28.31 68.16 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.572 1.149 . . . . 0.0 112.164 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.1 p -64.71 -24.39 67.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.404 1.082 . . . . 0.0 113.187 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -143.55 30.41 1.36 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.039 0.535 . . . . 0.0 110.457 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.1 -47.33 77.59 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.878 0.471 . . . . 0.0 110.542 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.35 165.62 12.03 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.971 0.909 . . . . 0.0 109.856 173.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.525 ' HZ2' ' HB2' ' A' ' 99' ' ' LYS . 4.6 ttmp? -138.52 154.27 48.77 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.881 0.872 . . . . 0.0 108.793 174.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -86.31 16.95 4.0 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.685 0.794 . . . . 0.0 112.251 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -67.45 -66.48 0.55 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.533 0.733 . . . . 0.0 110.832 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.415 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -59.9 -30.8 69.27 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.181 176.836 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -67.85 -45.17 75.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.135 0.974 . . . . 0.0 110.852 -176.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.45 -27.02 61.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.564 0.746 . . . . 0.0 110.903 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.03 81.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.434 0.694 . . . . 0.0 111.233 174.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 102' ' ' LEU . 42.5 mm -64.53 -42.06 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.953 0.901 . . . . 0.0 109.793 175.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.74 91.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.935 0.894 . . . . 0.0 111.383 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.08 -44.56 84.11 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.7 0.8 . . . . 0.0 109.378 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t -66.49 -36.44 82.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.516 0.726 . . . . 0.0 112.193 -175.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 48.9 mt -97.44 -26.18 14.94 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -171.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 64.4 tp -88.67 -31.34 18.56 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.034 0.534 . . . . 0.0 110.497 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 74.41 163.77 0.27 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 127.324 2.249 . . . . 0.0 111.334 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.1 m -94.98 119.0 66.55 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 123.4 0.68 . . . . 0.0 109.546 175.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 112.11 2.18 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.124 1.883 . . . . 0.0 110.112 172.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.507 ' HD3' ' H ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -86.97 50.94 2.11 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.089 0.947 . . . . 0.0 111.312 -171.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.463 HG22 ' HA3' ' A' ' 120' ' ' GLY . 47.4 mt -88.45 73.54 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -82.49 -49.48 9.88 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.804 -1.544 . . . . 0.0 109.545 -171.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -140.81 106.17 5.05 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 114.631 -1.168 . . . . 0.0 107.98 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.411 ' HA ' ' HB2' ' A' ' 123' ' ' LEU . 30.8 t70 75.24 -61.04 0.49 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.256 1.422 . . . . 0.0 112.068 -174.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.463 ' HA3' HG22 ' A' ' 116' ' ' ILE . . . 55.21 -98.98 0.06 OUTLIER Glycine 0 C--N 1.355 1.616 0 O-C-N 123.68 0.612 . . . . 0.0 113.582 -175.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.64 23.17 0.28 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.669 0.788 . . . . 0.0 110.411 177.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -146.46 16.91 1.32 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.104 0.478 . . . . 0.0 111.586 -171.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.411 ' HB2' ' HA ' ' A' ' 119' ' ' ASP . 0.2 OUTLIER -81.15 -6.25 58.62 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.912 0.485 . . . . 0.0 110.662 175.166 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -60.78 155.39 19.47 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.233 0.613 . . . . 0.0 109.915 169.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.07 6.23 1.07 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 125.705 1.602 . . . . 0.0 110.872 -178.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.8 ttt -82.73 109.91 17.31 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -100.58 139.62 36.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.119 0.567 . . . . 0.0 110.236 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -60.71 -48.12 83.21 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 51.78 73.7 0.3 Allowed 'General case' 0 C--N 1.351 0.668 0 O-C-N 125.092 1.495 . . . . 0.0 112.038 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 45.3 p -72.38 123.22 22.61 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.53 -178.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.6 m -73.91 -49.67 23.72 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.704 0.801 . . . . 0.0 110.008 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.403 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.722 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -61.52 -48.21 82.08 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.431 0.292 . . . . 0.0 111.081 -175.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.611 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -61.54 -40.93 96.44 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.345 1.058 . . . . 0.0 112.134 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.611 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -64.5 -51.38 63.25 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.929 0.892 . . . . 0.0 110.799 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -69.34 -44.09 72.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.294 1.038 . . . . 0.0 111.456 -172.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -64.64 -46.79 81.03 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.755 0.66 . . . . 0.0 110.949 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.465 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -61.39 -46.04 91.85 Favored 'General case' 0 C--N 1.363 1.188 0 O-C-N 123.552 0.533 . . . . 0.0 110.532 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -58.34 -36.95 74.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.782 0.833 . . . . 0.0 111.634 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.86 -45.54 64.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.015 0.526 . . . . 0.0 111.052 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.3 pt -83.22 -19.84 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.488 HG22 HD13 ' A' ' 58' ' ' LEU . 81.4 p -98.91 -40.73 7.94 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.267 0.627 . . . . 0.0 110.142 176.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.49 -3.23 57.74 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.131 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.695 HD13 HD12 ' A' ' 58' ' ' LEU . 61.6 mt -77.74 113.99 17.66 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 C-N-CA 123.588 0.755 . . . . 0.0 111.012 -172.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -81.26 -15.72 54.73 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.706 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.25 114.13 37.43 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.91 -15.86 29.45 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.776 2.317 . . . . 0.0 113.221 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -67.17 -51.02 58.81 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -55.63 -34.74 65.18 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 124.031 0.832 . . . . 0.0 111.881 176.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.465 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.2 mt -68.35 -53.81 21.53 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 123.911 0.757 . . . . 0.0 110.428 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -58.8 -38.26 78.19 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.757 175.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.455 ' HG2' HD11 ' A' ' 92' ' ' ILE . 41.8 mt-10 -74.97 -29.29 60.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.027 0.531 . . . . 0.0 111.806 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.3 77.43 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' HD13 ' A' ' 24' ' ' LEU . 4.3 mm? -76.42 -23.32 53.98 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.929 0.892 . . . . 0.0 110.073 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -70.45 -56.36 6.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.899 1.28 . . . . 0.0 110.44 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.71 69.36 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.974 0.91 . . . . 0.0 111.061 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.471 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 89.4 p -84.43 -5.75 59.31 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.516 0.726 . . . . 0.0 112.052 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 70.1 13.32 7.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.1 1.36 . . . . 0.0 112.025 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.08 42.84 1.59 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -132.4 115.52 15.68 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.501 0.72 . . . . 0.0 109.352 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.3 tt -74.13 -21.1 17.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.327 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 83.7 m -73.06 -49.81 26.51 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.221 0.608 . . . . 0.0 110.435 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.471 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 29.0 mm-40 -60.19 -40.38 89.82 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.785 172.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.82 -52.99 63.38 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.238 0.961 . . . . 0.0 112.263 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.457 HG21 HG21 ' A' ' 32' ' ' THR . 10.1 p -64.48 -36.0 76.04 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 C-N-CA 122.6 0.36 . . . . 0.0 110.446 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.7 t -63.03 -40.97 99.32 Favored 'General case' 0 CA--C 1.554 1.135 0 O-C-N 123.751 0.657 . . . . 0.0 111.27 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.56 -22.58 54.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.668 0.787 . . . . 0.0 111.648 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.695 HD12 HD13 ' A' ' 34' ' ' ILE . 82.5 mt -85.66 -29.21 24.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.529 0.331 . . . . 0.0 111.545 173.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.0 p -83.88 11.58 7.44 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.5 0.32 . . . . 0.0 111.019 174.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 64' ' ' LYS . 16.4 t70 -50.49 -41.3 53.09 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 123.815 0.846 . . . . 0.0 110.335 166.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -49.32 -34.87 16.75 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.758 1.223 . . . . 0.0 113.503 -177.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -99.15 -29.33 12.92 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.5 p -99.92 -0.25 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 122.852 0.461 . . . . 0.0 111.557 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 24.9 tttp -73.79 91.25 1.92 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 -178.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.17 144.7 90.97 Favored Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 123.798 0.839 . . . . 0.0 112.003 -176.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.61 106.26 0.86 Allowed 'Cis proline' 0 C--N 1.382 2.313 0 CA-C-N 119.546 0.873 . . . . 0.0 112.767 0.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 67.9 m -137.93 100.92 4.3 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 172.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -79.75 92.38 5.42 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 123.341 0.657 . . . . 0.0 110.104 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -150.22 130.87 14.01 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.051 0.94 . . . . 0.0 108.697 176.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.9 p -76.79 82.3 3.38 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 121.577 0.703 . . . . 0.0 109.429 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.85 137.22 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.516 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.06 69.98 8.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.748 0.785 . . . . 0.0 109.706 177.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.6 m -158.57 120.96 3.64 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 125.656 1.582 . . . . 0.0 107.449 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -75.98 150.35 83.42 Favored Pre-proline 0 CA--C 1.551 0.995 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.37 103.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.376 2.0 0 C-N-CA 123.224 2.616 . . . . 0.0 111.279 168.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 p -67.72 163.98 20.4 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.011 0.925 . . . . 0.0 111.358 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -116.32 -18.92 10.37 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.201 0.6 . . . . 0.0 112.405 -167.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 10.6 t -105.71 48.66 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 CA-C-O 121.864 0.84 . . . . 0.0 111.089 -165.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -87.35 70.96 10.01 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.758 0.79 . . . . 0.0 109.66 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.05 -8.55 60.23 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.878 165.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 m -81.26 79.75 7.83 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.637 1.175 . . . . 0.0 109.925 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -52.46 9.92 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.073 178.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 63.13 30.78 16.04 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.598 1.159 . . . . 0.0 111.38 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -73.09 88.45 1.43 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.539 0.736 . . . . 0.0 109.205 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -150.15 86.69 1.43 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.804 -173.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -76.26 90.67 3.17 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.477 0.711 . . . . 0.0 109.891 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.68 144.35 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.969 0.908 . . . . 0.0 110.028 178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.0 tp -103.39 38.44 1.78 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 122.134 0.968 . . . . 0.0 108.775 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.36 139.11 11.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.79 1.236 . . . . 0.0 108.126 -176.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 161.16 43.2 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.068 0.461 . . . . 0.0 111.202 -171.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 20.1 t -109.1 43.02 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 124.401 1.08 . . . . 0.0 108.416 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.455 HD11 ' HG2' ' A' ' 42' ' ' GLU . 8.2 mt -106.75 49.85 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -88.52 83.08 6.82 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.53 -3.56 13.65 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.363 -176.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 t -60.93 148.95 38.01 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.767 0.827 . . . . 0.0 111.906 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -153.63 92.25 1.56 Allowed 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.68 95.56 0.5 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.306 1.042 . . . . 0.0 111.591 -172.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -89.49 105.51 17.84 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 170.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -68.9 138.24 54.5 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -80.24 26.18 0.37 Allowed 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.119 0.968 . . . . 0.0 113.104 -171.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.32 -66.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.55 1.14 . . . . 0.0 110.513 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -23.58 61.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.503 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -63.19 -49.24 75.03 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 172.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.75 -38.09 85.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.652 0.595 . . . . 0.0 111.414 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.64 -49.37 68.91 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.79 0.836 . . . . 0.0 111.436 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.4 mm -67.48 -43.41 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.309 0.643 . . . . 0.0 110.467 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.406 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -57.83 -49.37 76.9 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 123.949 0.781 . . . . 0.0 111.143 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.38 -43.47 90.62 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.033 0.933 . . . . 0.0 109.604 -178.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.8 t -76.68 -14.08 59.99 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.115 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.11 -42.22 23.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 172.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 87.7 mt -66.55 -37.98 86.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.555 177.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 55.69 49.98 15.25 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.055 . . . . 0.0 111.178 -174.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 27.5 p -110.44 87.99 7.0 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.782 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.506 ' HB2' HG13 ' A' ' 116' ' ' ILE . 75.5 Cg_endo -82.01 147.55 14.93 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.587 2.191 . . . . 0.0 111.973 177.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.539 ' HE3' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -89.18 49.29 1.74 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 123.667 0.787 . . . . 0.0 110.025 -178.012 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.506 HG13 ' HB2' ' A' ' 114' ' ' PRO . 24.6 mt -82.14 64.91 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 122.404 1.097 . . . . 0.0 108.84 178.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -149.91 -13.05 0.27 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 109.379 -176.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -150.06 -59.53 0.2 Allowed 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.261 0.624 . . . . 0.0 110.866 -167.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -157.14 28.83 0.3 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.889 0.476 . . . . 0.0 112.068 -173.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -81.84 -96.84 0.46 Allowed Glycine 0 C--N 1.344 1.001 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.426 ' H ' HG12 ' A' ' 116' ' ' ILE . 7.5 mpt_? -126.56 27.73 6.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.748 0.819 . . . . 0.0 109.282 175.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.32 76.62 8.25 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-O 121.747 0.784 . . . . 0.0 110.481 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 37.3 tp -96.96 71.86 2.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.0 0.92 . . . . 0.0 108.737 175.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -81.42 137.54 35.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.59 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -99.81 42.98 1.08 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 172.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 54.0 ttp -65.56 122.13 16.52 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.157 0.983 . . . . 0.0 110.35 -178.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 48.9 m80 -123.54 103.8 8.66 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -78.55 165.31 23.86 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.247 1.019 . . . . 0.0 110.587 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.02 90.52 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.735 0.814 . . . . 0.0 110.544 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 22.3 m -90.3 -66.18 0.95 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.769 0.827 . . . . 0.0 110.599 -172.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.4 t -102.07 -5.88 24.01 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.081 0.553 . . . . 0.0 110.785 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.955 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.896 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.415 ' HG3' ' HB2' ' A' ' 25' ' ' LEU . 4.0 tp-100 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.8 tpp -52.72 -58.41 6.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.45 1.1 . . . . 0.0 113.235 -164.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.652 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.8 pt? -59.3 -36.88 76.4 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.772 0.829 . . . . 0.0 112.718 -177.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.652 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -66.55 -46.93 74.47 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.123 0.569 . . . . 0.0 110.333 177.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -65.75 -42.55 90.78 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.251 0.97 . . . . 0.0 110.882 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -64.51 -52.58 57.07 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 124.328 1.018 . . . . 0.0 111.001 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.561 HD22 ' HA ' ' A' ' 40' ' ' LEU . 22.2 tp -57.41 -46.97 82.92 Favored 'General case' 0 C--N 1.364 1.227 0 O-C-N 124.065 0.853 . . . . 0.0 110.264 178.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -53.96 -39.72 66.21 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.573 1.149 . . . . 0.0 111.769 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -72.55 -40.43 66.68 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.635 -176.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.0 pt -98.88 2.17 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 123.672 0.789 . . . . 0.0 112.584 -172.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.1 p -112.57 -42.49 3.64 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.307 0.643 . . . . 0.0 109.454 168.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.57 -13.87 38.97 Favored Glycine 0 N--CA 1.468 0.781 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.613 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.487 HD12 HD12 ' A' ' 58' ' ' LEU . 72.0 mt -75.16 110.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.35 0.602 0 C-N-CA 123.912 0.885 . . . . 0.0 110.332 -175.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -71.44 -32.73 68.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.057 0.943 . . . . 0.0 111.17 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -64.11 115.53 20.15 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 123.653 0.781 . . . . 0.0 111.53 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.483 ' HA ' HD12 ' A' ' 40' ' ' LEU . 42.2 Cg_endo -62.59 -22.62 74.19 Favored 'Trans proline' 0 C--N 1.391 2.812 0 C-N-CA 123.579 2.853 . . . . 0.0 112.97 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -54.43 -53.68 50.96 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.884 0.874 . . . . 0.0 110.976 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.89 -33.53 75.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.677 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.561 ' HA ' HD22 ' A' ' 28' ' ' LEU . 46.2 mt -72.28 -47.1 52.67 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 124.428 1.08 . . . . 0.0 111.038 -171.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -60.94 -54.42 45.28 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.709 0.63 . . . . 0.0 109.901 172.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.83 -30.15 68.75 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.876 0.735 . . . . 0.0 112.391 -174.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.34 -49.83 45.29 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 122.971 0.509 . . . . 0.0 110.317 174.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' HD13 ' A' ' 24' ' ' LEU . 3.4 mm? -59.04 -29.74 67.51 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.996 0.918 . . . . 0.0 111.246 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -71.65 -51.0 25.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.401 0.68 . . . . 0.0 109.794 174.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.73 62.59 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.713 0.805 . . . . 0.0 112.434 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -104.4 4.27 33.18 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.551 0.74 . . . . 0.0 112.374 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.6 t30 70.66 -2.63 2.18 Favored 'General case' 0 CA--C 1.571 1.751 0 C-N-CA 124.579 1.152 . . . . 0.0 111.582 -176.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.18 -6.95 10.79 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.777 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -79.28 105.95 10.97 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.006 0.523 . . . . 0.0 110.201 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.462 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.2 tt -65.24 -27.21 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 C-N-CA 122.914 0.485 . . . . 0.0 112.167 -173.473 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 36.3 m -66.01 -47.39 74.63 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 123.496 0.719 . . . . 0.0 110.685 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.409 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 21.1 mm-40 -60.9 -39.26 88.67 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.604 174.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.34 -41.54 89.42 Favored 'General case' 0 C--O 1.246 0.869 0 O-C-N 124.051 0.845 . . . . 0.0 111.856 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.3 t -59.18 -50.09 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 123.723 0.64 . . . . 0.0 109.71 173.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m -56.7 -41.74 77.91 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 124.307 1.004 . . . . 0.0 111.482 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -74.1 -29.85 62.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.684 0.794 . . . . 0.0 111.898 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.487 HD12 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -84.17 -32.53 24.55 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 177.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.7 p -79.84 -18.78 49.97 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -76.15 -4.25 40.58 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -175.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.21 -37.44 74.82 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.387 0.675 . . . . 0.0 111.326 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -77.63 -11.54 59.88 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.794 0.837 . . . . 0.0 111.889 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.55 -26.3 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.243 0.617 . . . . 0.0 109.682 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.85 102.77 5.64 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 177.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.517 ' HA ' ' H ' ' A' ' 67' ' ' SER . 13.7 pt-20 -67.66 153.54 94.87 Favored Pre-proline 0 CA--C 1.566 1.581 0 C-N-CA 123.854 0.862 . . . . 0.0 110.982 175.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -84.69 93.68 0.14 OUTLIER 'Cis proline' 0 C--N 1.387 2.581 0 CA-C-N 120.474 1.205 . . . . 0.0 113.302 2.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.517 ' H ' ' HA ' ' A' ' 65' ' ' GLU . 12.0 p -94.91 -74.0 0.56 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.997 0.919 . . . . 0.0 109.851 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 179.4 145.61 0.18 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.866 1.267 . . . . 0.0 108.691 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.63 38.39 0.69 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.663 0.785 . . . . 0.0 111.279 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.7 t -79.31 -178.55 6.28 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.002 0.921 . . . . 0.0 110.835 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.7 m -52.52 117.95 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 C-N-CA 124.56 1.144 . . . . 0.0 112.183 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.03 95.16 2.8 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.953 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.0 t -94.52 176.04 6.44 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.261 0.624 . . . . 0.0 109.729 177.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -69.18 138.8 89.68 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 123.463 0.705 . . . . 0.0 111.496 -172.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.65 174.75 12.11 Favored 'Trans proline' 0 C--N 1.382 2.333 0 C-N-CA 123.081 2.521 . . . . 0.0 111.535 173.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.1 m 59.14 29.27 18.79 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.117 0.967 . . . . 0.0 110.827 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.05 -45.29 89.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.072 0.949 . . . . 0.0 110.393 -177.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -70.35 143.62 14.48 Favored 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.024 178.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.48 98.64 1.87 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.589 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.22 -30.58 64.85 Favored Glycine 0 C--N 1.346 1.088 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.44 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 29.7 t 58.69 25.1 12.93 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.26 1.024 . . . . 0.0 110.891 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -115.71 77.83 1.12 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.76 1.224 . . . . 0.0 108.204 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -73.13 80.99 1.27 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.349 0.66 . . . . 0.0 109.786 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.405 HD21 ' N ' ' A' ' 84' ' ' ASN . 0.8 OUTLIER -76.56 95.96 4.02 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -93.88 32.86 1.38 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.553 0.741 . . . . 0.0 110.152 178.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.21 100.41 1.68 Allowed 'General case' 0 C--N 1.348 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.565 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.0 t -65.24 122.18 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 124.197 0.936 . . . . 0.0 109.554 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -84.52 -24.72 29.22 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.012 0.525 . . . . 0.0 110.403 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.78 108.53 12.28 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.232 0.613 . . . . 0.0 111.191 -177.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.45 ' HG2' ' H ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -145.14 170.44 16.22 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.515 1.126 . . . . 0.0 108.252 172.58 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -114.4 27.16 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 CA-C-O 122.585 1.183 . . . . 0.0 109.075 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.45 ' H ' ' HG2' ' A' ' 90' ' ' LYS . 47.5 mt -110.46 78.22 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.511 -176.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -162.34 87.71 0.63 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.375 -1.284 . . . . 0.0 107.566 166.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -101.21 -30.83 11.32 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.913 -177.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 t -103.81 124.32 48.7 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 121.838 0.828 . . . . 0.0 111.823 -174.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -168.66 38.66 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.62 1.568 . . . . 0.0 106.942 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.07 -49.02 14.77 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.531 -168.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -70.41 110.69 5.47 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 123.982 0.802 . . . . 0.0 109.51 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.56 145.66 30.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.101 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.462 ' HA ' ' NE2' ' A' ' 103' ' ' GLN . 31.0 t70 -87.67 -1.32 57.88 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.378 0.671 . . . . 0.0 110.606 -178.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.6 -51.04 64.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.492 1.117 . . . . 0.0 111.726 -179.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -22.91 53.6 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.462 ' NE2' ' HA ' ' A' ' 100' ' ' ASP . 2.3 mp0 -61.1 -55.98 26.2 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 170.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.14 79.75 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.635 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.57 -56.17 8.08 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.398 0.679 . . . . 0.0 111.414 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.7 mm -64.22 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.226 0.61 . . . . 0.0 110.369 -178.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.25 -47.18 80.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.307 0.643 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.9 tp -65.82 -31.57 72.6 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 122.702 0.401 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.3 t -71.62 -33.61 69.11 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.548 0.739 . . . . 0.0 110.864 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 41.6 tp -71.43 -44.6 64.55 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.903 0.881 . . . . 0.0 111.022 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.38 -32.57 68.62 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.002 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 49.61 20.7 0.53 Allowed 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 126.876 2.07 . . . . 0.0 114.156 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.9 p -128.24 120.74 21.28 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.199 1.0 . . . . 0.0 108.306 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.45 75.63 2.92 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.641 2.227 . . . . 0.0 111.366 174.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? 66.51 8.08 5.52 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 125.034 1.334 . . . . 0.0 112.385 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 42.9 mm -80.02 95.74 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -122.49 62.06 0.98 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.651 0.78 . . . . 0.0 109.579 -177.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 75.9 -24.94 0.21 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.868 1.267 . . . . 0.0 113.269 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -85.65 -22.48 27.89 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.835 0.854 . . . . 0.0 112.2 -175.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -82.31 -123.46 0.75 Allowed Glycine 0 C--N 1.354 1.575 0 O-C-N 123.178 0.299 . . . . 0.0 113.359 -173.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -3.96 22.18 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 124.077 0.951 . . . . 0.0 112.998 -179.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.71 -21.46 66.53 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 125.045 1.338 . . . . 0.0 111.877 -178.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tt 70.63 100.83 0.06 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 125.159 1.384 . . . . 0.0 108.532 -177.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -154.31 147.75 25.06 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.04 0.936 . . . . 0.0 108.731 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -75.09 83.98 2.31 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -111.66 -29.25 7.79 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.221 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -95.66 92.07 6.42 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -76.06 104.6 6.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.042 0.537 . . . . 0.0 110.24 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.21 105.47 6.25 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.098 0.559 . . . . 0.0 110.603 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 21.4 m -88.31 127.23 35.47 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.226 0.611 . . . . 0.0 109.727 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 30.0 t -82.99 -34.62 26.31 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.067 0.547 . . . . 0.0 110.336 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.261 1.024 . . . . 0.0 109.076 -177.161 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -59.21 -35.54 73.79 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.268 1.027 . . . . 0.0 112.861 -171.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.43 HD13 ' HG ' ' A' ' 44' ' ' LEU . 2.3 pt? -64.55 -39.57 94.0 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.481 0.713 . . . . 0.0 111.578 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.95 -48.16 69.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.688 0.795 . . . . 0.0 110.161 175.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -62.09 -49.9 74.08 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.618 1.199 . . . . 0.0 110.978 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.42 ' O ' HG12 ' A' ' 31' ' ' ILE . 7.9 mm100 -62.45 -56.33 19.2 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.462 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.478 HD23 HD21 ' A' ' 44' ' ' LEU . 20.5 tp -57.56 -45.26 85.37 Favored 'General case' 0 C--N 1.36 1.061 0 O-C-N 123.784 0.677 . . . . 0.0 110.685 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -55.6 -45.28 77.47 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.77 0.828 . . . . 0.0 111.243 176.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.25 -34.96 79.18 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.296 0.638 . . . . 0.0 111.29 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.8 pt -104.8 2.42 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -173.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.1 p -112.33 -50.48 2.9 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.511 0.672 . . . . 0.0 109.668 167.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.49 22.53 10.31 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.927 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.424 HD12 HD13 ' A' ' 58' ' ' LEU . 62.4 mt -101.59 122.76 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.242 0.617 . . . . 0.0 110.28 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -81.59 -26.45 34.91 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.174 0.99 . . . . 0.0 111.91 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.13 112.54 10.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.082 0.553 . . . . 0.0 110.525 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.89 -22.01 49.49 Favored 'Trans proline' 0 C--N 1.385 2.456 0 C-N-CA 122.906 2.404 . . . . 0.0 111.872 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -57.28 -52.25 66.1 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.233 0.958 . . . . 0.0 110.188 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -60.72 -40.84 93.79 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.193 0.933 . . . . 0.0 111.584 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.457 ' HA ' HD22 ' A' ' 28' ' ' LEU . 66.0 mt -68.15 -46.28 71.23 Favored 'General case' 0 C--O 1.246 0.887 0 O-C-N 124.083 0.864 . . . . 0.0 111.488 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 71.2 m-70 -64.96 -51.16 63.31 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.328 176.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -58.0 -33.08 68.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.285 0.634 . . . . 0.0 112.18 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.11 -48.88 61.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 123.747 0.654 . . . . 0.0 110.419 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.478 HD21 HD23 ' A' ' 28' ' ' LEU . 3.3 mm? -61.1 -29.64 69.88 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.903 0.881 . . . . 0.0 111.385 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -76.27 -48.19 21.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.793 0.837 . . . . 0.0 110.704 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.89 -35.3 80.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.784 0.834 . . . . 0.0 111.094 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.0 m -87.77 1.92 52.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.649 0.78 . . . . 0.0 111.571 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.433 HD21 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER 66.44 12.16 8.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.848 1.259 . . . . 0.0 112.6 174.901 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.57 -11.87 11.15 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-O 119.805 -0.442 . . . . 0.0 112.865 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -77.97 104.88 8.81 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 121.293 0.568 . . . . 0.0 110.483 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.492 ' O ' HG21 ' A' ' 55' ' ' VAL . 18.0 tt -64.04 -26.17 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.014 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.3 m -65.13 -52.77 53.26 Favored 'General case' 0 C--O 1.251 1.179 0 C-N-CA 123.685 0.794 . . . . 0.0 110.908 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.465 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 14.3 mm100 -62.15 -37.93 87.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.815 174.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.72 -44.36 81.53 Favored 'General case' 0 C--O 1.247 0.948 0 O-C-N 124.114 0.884 . . . . 0.0 111.848 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.492 HG21 ' O ' ' A' ' 51' ' ' ILE . 59.6 t -59.31 -50.36 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 122.918 0.487 . . . . 0.0 109.806 172.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m -56.99 -35.75 69.56 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.333 1.021 . . . . 0.0 112.169 -175.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 76.7 mt -72.89 -44.02 61.78 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.939 0.495 . . . . 0.0 110.395 178.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.424 HD13 HD12 ' A' ' 34' ' ' ILE . 58.6 mt -78.03 -10.15 59.47 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.4 p -110.21 6.55 22.72 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.86 0.464 . . . . 0.0 110.825 175.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -78.93 -30.53 44.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.969 0.507 . . . . 0.0 111.152 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.454 ' HA ' ' HE2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -61.77 -20.74 63.91 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -172.008 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -82.55 -18.41 41.5 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.991 0.916 . . . . 0.0 111.95 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.8 p -123.19 3.0 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 123.752 0.821 . . . . 0.0 110.09 -177.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.454 ' HE2' ' HA ' ' A' ' 61' ' ' GLU . 23.8 ttmm -68.1 88.81 0.29 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.445 1.098 . . . . 0.0 110.819 -176.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -126.6 134.86 26.49 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.782 . . . . 0.0 109.23 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -75.62 165.65 85.1 Favored 'Cis proline' 0 C--N 1.377 2.077 0 CA-C-N 119.787 0.96 . . . . 0.0 113.28 3.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -72.78 168.95 17.75 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.759 0.824 . . . . 0.0 110.88 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -137.3 111.35 8.35 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -178.294 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -70.06 105.91 3.05 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.556 0.742 . . . . 0.0 110.41 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.3 p -65.76 152.62 43.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.153 0.981 . . . . 0.0 111.256 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.49 137.52 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.171 0.989 . . . . 0.0 112.232 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.34 54.69 2.37 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.129 0.972 . . . . 0.0 110.928 -179.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -76.44 86.46 3.18 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 122.28 1.038 . . . . 0.0 110.641 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.51 146.03 88.3 Favored Pre-proline 0 CA--C 1.546 0.817 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.829 178.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -58.13 116.76 3.47 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.707 2.272 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.7 p -67.78 -176.51 0.66 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.627 0.771 . . . . 0.0 111.391 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.91 78.37 0.31 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.371 0.669 . . . . 0.0 111.192 -174.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.8 p -91.16 95.89 5.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 122.225 1.012 . . . . 0.0 108.666 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.11 100.01 2.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.282 -174.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -172.5 -68.66 0.04 OUTLIER Glycine 0 C--N 1.341 0.86 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.3 t -82.03 -29.58 31.89 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.75 -24.07 61.71 Favored 'General case' 0 C--N 1.354 0.774 0 C-N-CA 123.352 0.661 . . . . 0.0 110.49 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.58 107.74 7.93 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.756 177.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -91.18 95.0 9.83 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -144.47 105.63 4.21 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.401 0.681 . . . . 0.0 109.307 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -78.22 131.37 37.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.541 0.736 . . . . 0.0 109.565 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 56.7 t -90.37 120.72 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -91.3 80.66 5.53 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -177.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -139.86 120.54 14.28 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.099 -174.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.92 157.31 37.57 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.212 0.605 . . . . 0.0 109.85 174.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.7 t -121.87 34.52 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-O 122.294 1.045 . . . . 0.0 108.227 174.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mt -86.23 77.09 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.41 85.02 3.15 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.563 -1.198 . . . . 0.0 109.232 172.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.84 36.84 3.07 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.115 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.9 p -88.83 -8.07 55.02 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.222 -1.354 . . . . 0.0 110.497 173.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -118.06 97.81 6.0 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.602 0.761 . . . . 0.0 109.673 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -112.46 -30.69 7.06 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.341 0.656 . . . . 0.0 109.752 173.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -96.92 137.17 36.41 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.625 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -100.6 143.9 30.22 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -92.76 5.52 50.85 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.481 1.112 . . . . 0.0 112.181 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.87 -45.64 70.48 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.074 0.55 . . . . 0.0 111.614 -170.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.39 -32.35 68.35 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.463 0.705 . . . . 0.0 110.381 -178.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -66.71 -44.64 81.11 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.97 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.22 -35.17 79.03 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 124.104 0.878 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.39 8.37 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.675 0.79 . . . . 0.0 111.073 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.0 mm -61.6 -46.06 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.112 0.965 . . . . 0.0 110.966 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.32 82.31 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.131 0.895 . . . . 0.0 111.149 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -49.44 77.79 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.746 0.654 . . . . 0.0 109.432 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 45.2 m -59.38 -38.24 79.98 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.964 0.79 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.0 mt -81.72 -18.53 44.05 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.531 0.733 . . . . 0.0 111.812 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 80.1 mt -85.37 -21.26 28.94 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.08 0.552 . . . . 0.0 110.621 172.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -76.21 -13.82 60.16 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.333 0.653 . . . . 0.0 110.713 171.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.446 ' HB3' ' O ' ' A' ' 116' ' ' ILE . 32.9 m -90.01 104.03 7.7 Favored Pre-proline 0 CA--C 1.556 1.199 0 C-N-CA 124.239 1.016 . . . . 0.0 110.154 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -85.13 84.18 1.41 Allowed 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 123.199 2.599 . . . . 0.0 111.211 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? 69.88 13.22 7.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.515 1.126 . . . . 0.0 111.812 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.446 ' O ' ' HB3' ' A' ' 113' ' ' SER . 10.9 mm -118.17 87.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -57.11 -39.59 75.39 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.509 0.723 . . . . 0.0 112.235 -177.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -178.24 172.28 1.56 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.255 1.422 . . . . 0.0 108.768 177.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.2 t70 70.25 -71.21 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.827 1.251 . . . . 0.0 112.431 173.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 149.84 116.89 0.82 Allowed Glycine 0 C--N 1.345 1.039 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -110.48 -62.46 1.52 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.057 0.543 . . . . 0.0 109.634 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.0 t70 63.52 11.29 5.52 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 125.235 1.414 . . . . 0.0 112.8 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.3 -37.54 66.18 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.947 0.899 . . . . 0.0 109.715 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -67.78 105.4 1.93 Allowed 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.324 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -164.3 109.14 0.98 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.1 mtt -70.13 96.65 1.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.229 0.612 . . . . 0.0 109.393 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -79.6 82.13 5.76 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.542 0.686 . . . . 0.0 110.355 -175.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -24.8 56.53 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.564 174.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.58 118.3 18.27 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.718 0.807 . . . . 0.0 110.144 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 72.0 m -129.19 136.47 50.19 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 124.419 1.088 . . . . 0.0 108.595 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -70.62 112.4 6.84 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.555 0.742 . . . . 0.0 109.661 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.938 0 C-N-CA 123.363 0.665 . . . . 0.0 109.68 178.365 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.5 ttm -56.34 -53.31 58.77 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 124.203 1.001 . . . . 0.0 112.41 -169.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.481 ' HG ' HD21 ' A' ' 25' ' ' LEU . 2.2 pt? -51.57 -41.28 61.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.035 0.934 . . . . 0.0 112.605 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.481 HD21 ' HG ' ' A' ' 24' ' ' LEU . 4.5 mm? -62.99 -52.36 63.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.679 0.792 . . . . 0.0 109.961 176.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -67.37 -39.97 85.72 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 124.218 0.949 . . . . 0.0 111.723 -172.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.447 ' O ' HG12 ' A' ' 31' ' ' ILE . 18.7 mm100 -65.52 -50.42 65.32 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.488 0.715 . . . . 0.0 110.218 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.536 HD22 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -61.55 -45.09 95.65 Favored 'General case' 0 C--N 1.357 0.919 0 O-C-N 123.878 0.737 . . . . 0.0 110.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -56.77 -37.78 71.55 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.595 1.158 . . . . 0.0 111.746 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.59 -51.08 64.59 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.893 0.877 . . . . 0.0 110.496 177.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 27' ' ' GLN . 5.8 pt -96.48 2.38 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -169.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.445 HG23 HD13 ' A' ' 58' ' ' LEU . 73.1 p -110.55 -37.97 5.32 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 167.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.4 -9.07 58.99 Favored Glycine 0 C--N 1.342 0.913 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.012 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.564 HD11 HD12 ' A' ' 58' ' ' LEU . 64.9 mt -79.58 112.17 17.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.491 0 C-N-CA 123.641 0.776 . . . . 0.0 110.409 -174.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -73.11 -29.21 62.75 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.717 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 20.0 t70 -63.09 115.33 16.76 Favored Pre-proline 0 C--N 1.35 0.611 0 C-N-CA 124.0 0.92 . . . . 0.0 111.094 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.442 ' HA ' HD11 ' A' ' 40' ' ' LEU . 58.2 Cg_endo -67.89 -25.92 38.48 Favored 'Trans proline' 0 C--N 1.381 2.287 0 C-N-CA 122.85 2.367 . . . . 0.0 112.744 -176.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.9 m -63.34 -46.6 85.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.677 0.791 . . . . 0.0 111.38 -175.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -61.07 -34.56 75.09 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.576 0.75 . . . . 0.0 111.511 174.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.536 ' HA ' HD22 ' A' ' 28' ' ' LEU . 44.6 mt -70.96 -42.06 70.27 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.856 0.723 . . . . 0.0 110.874 -177.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -66.68 -48.08 70.43 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.934 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.03 -27.33 65.57 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.233 0.333 . . . . 0.0 111.497 -177.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.09 -37.37 69.58 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.629 0.371 . . . . 0.0 110.441 172.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.46 HD23 HD23 ' A' ' 28' ' ' LEU . 1.8 mm? -73.13 -23.96 60.54 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.727 0.811 . . . . 0.0 109.501 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -74.37 -51.68 14.36 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.804 1.241 . . . . 0.0 110.3 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.13 -16.52 63.67 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.817 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.462 ' HG ' ' HB2' ' A' ' 54' ' ' ALA . 92.6 p -101.2 -7.19 23.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.303 0.641 . . . . 0.0 111.76 176.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 64.54 22.62 12.71 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.532 1.133 . . . . 0.0 111.583 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.76 -7.54 31.64 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.933 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.52 112.21 14.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.018 0.527 . . . . 0.0 109.718 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.562 ' O ' HG21 ' A' ' 55' ' ' VAL . 9.3 tp -59.72 -42.08 87.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.997 -175.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.8 m -64.02 -46.43 84.52 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 124.07 0.948 . . . . 0.0 111.206 -173.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -63.14 -42.98 99.58 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.767 176.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.462 ' HB2' ' HG ' ' A' ' 47' ' ' SER . . . -57.35 -42.62 82.37 Favored 'General case' 0 C--O 1.247 0.949 0 O-C-N 123.906 0.754 . . . . 0.0 111.512 178.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.562 HG21 ' O ' ' A' ' 51' ' ' ILE . 47.0 t -60.17 -49.35 84.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.308 0.643 . . . . 0.0 109.773 175.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.4 t -62.59 -35.47 79.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.857 0.723 . . . . 0.0 112.025 -177.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.59 -27.0 55.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.565 0.746 . . . . 0.0 111.539 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.564 HD12 HD11 ' A' ' 34' ' ' ILE . 72.1 mt -86.85 -38.94 16.32 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 173.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.438 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 77.5 p -76.62 -2.33 32.07 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.292 0.637 . . . . 0.0 110.896 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -51.94 -33.87 39.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.028 1.331 . . . . 0.0 111.393 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -54.54 -36.72 64.58 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.793 1.237 . . . . 0.0 113.533 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 59' ' ' THR . 12.2 ptt180 -75.25 -23.63 57.52 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.602 0.761 . . . . 0.0 110.391 -174.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.3 t -96.14 -28.76 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.702 0.801 . . . . 0.0 110.022 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -72.64 92.95 1.57 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.919 0.888 . . . . 0.0 110.874 -166.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -63.06 146.22 95.97 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 124.063 0.945 . . . . 0.0 112.606 -175.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.64 105.43 0.72 Allowed 'Cis proline' 0 C--N 1.38 2.223 0 C-N-CA 124.358 -1.101 . . . . 0.0 112.42 -2.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.0 m -80.59 148.59 30.24 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.845 0.458 . . . . 0.0 110.594 177.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -78.82 111.56 15.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.82 116.46 5.27 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.52 0.676 . . . . 0.0 110.202 177.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.6 p -86.16 -170.99 3.35 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.085 0.954 . . . . 0.0 111.188 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.3 p -64.37 129.69 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.284 0 C-N-CA 122.635 0.374 . . . . 0.0 110.522 176.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.58 3.83 45.55 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.419 0.687 . . . . 0.0 111.713 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 54.4 m -64.59 129.66 40.67 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.432 0.693 . . . . 0.0 111.384 178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.55 145.46 98.28 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.176 176.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.76 115.68 2.5 Favored 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 122.782 2.321 . . . . 0.0 112.434 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -64.46 108.19 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.363 1.065 . . . . 0.0 109.956 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -155.79 36.07 0.35 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.345 0.658 . . . . 0.0 110.771 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.95 120.95 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.019 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -78.3 89.63 4.34 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.808 0.843 . . . . 0.0 109.887 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -81.99 -28.99 39.53 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 46.1 t -116.11 83.1 1.89 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.657 1.183 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.42 -50.75 4.86 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.207 1.003 . . . . 0.0 110.029 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -161.0 132.8 5.74 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.241 1.016 . . . . 0.0 109.785 177.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -89.33 94.57 9.95 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -112.64 99.3 7.83 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 177.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -70.2 132.29 45.53 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.747 0.419 . . . . 0.0 110.191 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.38 111.19 7.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.24 89.43 5.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.49 152.89 37.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.185 -179.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.9 163.98 30.89 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.431 0.292 . . . . 0.0 110.78 -171.11 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 14.8 t -127.78 44.71 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 171.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 38.9 mm -84.9 -9.95 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.146 177.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.24 65.03 0.81 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.066 1.346 . . . . 0.0 111.266 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -116.86 78.36 1.2 Allowed 'General case' 0 C--O 1.242 0.682 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 43.7 p -75.62 94.48 3.2 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.903 176.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -56.07 129.71 41.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.489 0.716 . . . . 0.0 110.719 -178.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -64.62 102.79 0.6 Allowed 'General case' 0 CA--C 1.537 0.46 0 O-C-N 123.73 0.644 . . . . 0.0 110.408 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.54 ' HB3' HD13 ' A' ' 102' ' ' LEU . 19.6 t-20 -77.61 -176.65 4.4 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -60.21 146.17 44.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.099 0.409 . . . . 0.0 109.96 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -52.41 -19.64 2.31 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.18 1.392 . . . . 0.0 112.92 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -36.81 -65.89 0.26 Allowed 'General case' 0 C--O 1.247 0.925 0 C-N-CA 126.902 2.081 . . . . 0.0 113.881 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.54 HD13 ' HB3' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -76.36 -33.07 58.94 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 119.156 -0.45 . . . . 0.0 112.045 -173.446 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -59.73 -41.51 91.09 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.198 0.454 . . . . 0.0 109.91 174.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.99 -46.33 78.4 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.291 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.49 96.39 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.312 1.008 . . . . 0.0 112.345 -177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 102' ' ' LEU . 49.0 mm -72.48 -45.27 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.443 0.697 . . . . 0.0 110.688 -176.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -28.13 65.71 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.949 0.5 . . . . 0.0 111.289 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 33.2 tp -71.01 -46.09 62.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.212 0.605 . . . . 0.0 109.39 175.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -58.38 -36.03 72.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.768 0.667 . . . . 0.0 110.813 175.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.14 -49.43 69.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 110.115 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.7 pp -71.78 -34.96 69.87 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.168 0.293 . . . . 0.0 111.295 -175.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.07 -38.85 63.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.119 0.567 . . . . 0.0 112.102 -177.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.8 p -66.68 142.09 97.33 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.584 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -55.56 135.72 70.65 Favored 'Trans proline' 0 C--N 1.38 2.188 0 C-N-CA 122.331 2.02 . . . . 0.0 111.972 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.438 ' HE3' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -66.97 -23.64 65.97 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.745 0.818 . . . . 0.0 110.274 178.681 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 45.7 mm -68.97 108.18 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.347 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -103.89 6.64 36.56 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.676 0.79 . . . . 0.0 110.545 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 121' ' ' ARG . . . -151.42 93.8 1.94 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.115 0.966 . . . . 0.0 109.606 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 56.27 -78.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 126.093 1.757 . . . . 0.0 113.487 172.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.67 39.14 0.12 Allowed Glycine 0 C--N 1.342 0.877 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 118' ' ' ALA . 26.9 mmm180 -68.71 -46.03 70.05 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.568 0.747 . . . . 0.0 111.593 -174.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 73.71 -13.87 0.7 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.913 1.285 . . . . 0.0 112.755 177.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -95.37 95.08 8.22 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 -178.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -163.39 145.3 9.7 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.831 0.852 . . . . 0.0 109.627 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 62.01 28.54 17.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -71.52 88.72 0.93 Allowed 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 122.314 1.054 . . . . 0.0 111.415 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -135.73 130.92 34.9 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.216 1.006 . . . . 0.0 108.336 174.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -147.01 -57.31 0.26 Allowed 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -143.75 97.34 3.05 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.733 0.813 . . . . 0.0 109.542 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 41.5 m -72.35 85.1 1.09 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.268 0.627 . . . . 0.0 109.357 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 18.0 m -94.86 -55.65 3.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.606 0.762 . . . . 0.0 110.062 -178.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.946 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.781 -176.667 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.2 tpt -54.19 -51.58 63.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.437 1.095 . . . . 0.0 111.867 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.637 ' HG ' HD21 ' A' ' 25' ' ' LEU . 2.2 pt? -57.42 -35.44 70.08 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.174 0.989 . . . . 0.0 112.718 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.637 HD21 ' HG ' ' A' ' 24' ' ' LEU . 3.9 mm? -68.83 -46.48 68.46 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -69.55 -39.01 77.7 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.292 0.995 . . . . 0.0 110.529 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.26 -53.21 58.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.304 1.042 . . . . 0.0 110.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -58.15 -47.92 81.86 Favored 'General case' 0 C--N 1.36 1.043 0 O-C-N 123.862 0.726 . . . . 0.0 110.349 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -53.02 -42.23 65.48 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.764 1.225 . . . . 0.0 111.404 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.66 -46.47 79.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.041 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.5 pt -96.02 2.33 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 113.512 0.931 . . . . 0.0 113.512 -171.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.51 HG23 HD11 ' A' ' 58' ' ' LEU . 69.1 p -110.0 -41.78 4.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.049 0.54 . . . . 0.0 109.831 169.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.61 7.18 59.2 Favored Glycine 0 C--N 1.343 0.949 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.678 -176.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.522 HD12 HD13 ' A' ' 58' ' ' LEU . 79.0 mt -95.74 110.08 23.72 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 C-N-CA 124.053 0.941 . . . . 0.0 109.306 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -77.5 -17.74 57.7 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.9 0.88 . . . . 0.0 111.107 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.422 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 3.0 m-20 -65.19 108.08 1.84 Allowed Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 124.997 1.319 . . . . 0.0 110.011 -177.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.28 -26.75 35.28 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 123.114 2.543 . . . . 0.0 112.384 -171.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.7 t -62.39 -47.83 82.43 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.025 0.53 . . . . 0.0 109.858 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -57.89 -36.15 72.01 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.07 0.856 . . . . 0.0 111.492 176.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 mt -71.22 -51.12 26.47 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 123.972 0.795 . . . . 0.0 111.216 -174.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -60.62 -42.35 96.68 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.237 0.615 . . . . 0.0 111.585 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.477 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 40.4 mt-10 -65.99 -35.59 80.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.119 0.568 . . . . 0.0 112.144 -179.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -44.77 66.43 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 123.536 0.523 . . . . 0.0 110.572 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.552 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.7 mm? -61.67 -35.55 78.29 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 124.187 0.929 . . . . 0.0 110.172 176.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.7 tmmm? -68.38 -45.29 73.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.843 0.857 . . . . 0.0 110.174 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.95 -17.97 63.34 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.789 0.836 . . . . 0.0 112.018 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 77.4 p -103.72 0.76 30.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.735 0.814 . . . . 0.0 111.507 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.0 m120 65.0 14.69 9.52 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.963 1.305 . . . . 0.0 112.435 -178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.59 12.46 Favored Glycine 0 C--N 1.353 1.472 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.873 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -79.14 99.26 6.89 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 117.571 0.685 . . . . 0.0 109.521 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.47 ' O ' HG23 ' A' ' 55' ' ' VAL . 17.5 tt -61.05 -29.29 45.4 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.306 0.642 . . . . 0.0 112.518 -172.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 26.8 m -64.78 -47.73 77.06 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.896 0.478 . . . . 0.0 110.608 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -63.37 -35.67 81.16 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.562 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.78 89.22 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.118 0.886 . . . . 0.0 111.274 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 51' ' ' ILE . 41.1 t -59.0 -51.84 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.466 174.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.7 t -57.71 -39.66 77.75 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.949 1.405 . . . . 0.0 111.195 -175.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.72 -29.94 61.35 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.139 0.576 . . . . 0.0 111.808 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.522 HD13 HD12 ' A' ' 34' ' ' ILE . 72.5 mt -76.26 -38.08 56.73 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 123.239 0.337 . . . . 0.0 111.821 173.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.3 p -86.05 -28.3 24.2 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.495 ' HA ' HG12 ' A' ' 63' ' ' VAL . 39.2 m-20 -67.79 -21.92 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.27 -37.77 78.45 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.228 0.611 . . . . 0.0 111.359 175.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -98.54 -9.34 25.07 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -176.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.495 HG12 ' HA ' ' A' ' 60' ' ' ASP . 9.6 p -125.26 16.73 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 CA-C-N 118.345 0.52 . . . . 0.0 111.103 -177.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -65.45 98.22 0.34 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 121.619 0.723 . . . . 0.0 111.016 176.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -135.4 114.43 11.43 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 173.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -72.55 138.31 54.08 Favored 'Cis proline' 0 C--N 1.387 2.603 0 CA-C-N 119.861 0.986 . . . . 0.0 113.676 6.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -84.4 -3.13 58.13 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.43 1.092 . . . . 0.0 112.063 -174.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -64.8 142.96 58.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.373 0.669 . . . . 0.0 109.848 177.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.95 108.12 3.88 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.265 0.626 . . . . 0.0 110.7 -175.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 t -74.76 173.29 10.74 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.711 0.804 . . . . 0.0 110.501 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.2 m -81.28 61.35 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 CA-C-O 121.9 0.857 . . . . 0.0 110.685 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.98 69.6 6.39 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.257 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 m -147.28 111.87 5.29 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -104.43 151.81 39.22 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 123.758 0.823 . . . . 0.0 110.771 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.32 122.88 12.56 Favored 'Trans proline' 0 C--N 1.381 2.24 0 C-N-CA 123.067 2.511 . . . . 0.0 111.644 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.9 m -101.97 110.12 22.02 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.538 0.735 . . . . 0.0 110.075 178.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -80.2 -16.8 54.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.686 0.794 . . . . 0.0 111.258 178.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.17 109.35 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.52 0.728 . . . . 0.0 110.7 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -73.76 109.97 7.69 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.383 0.673 . . . . 0.0 109.253 177.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.39 -27.01 67.06 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.75 0.656 . . . . 0.0 113.112 178.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 78.4 p 49.59 42.24 22.73 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.406 1.482 . . . . 0.0 111.952 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.31 72.14 5.29 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.316 -171.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -118.22 115.16 24.2 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 109.724 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -130.8 103.81 6.8 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.328 0.651 . . . . 0.0 109.644 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -106.99 104.65 14.37 Favored 'General case' 0 C--O 1.244 0.806 0 C-N-CA 123.584 0.754 . . . . 0.0 109.426 176.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -144.68 124.12 13.13 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.706 0.802 . . . . 0.0 109.534 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.51 140.36 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 168.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 tp -96.63 46.65 1.06 Allowed 'General case' 0 CA--C 1.55 0.974 0 CA-C-O 122.521 1.153 . . . . 0.0 108.435 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -132.13 148.83 52.5 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.743 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 tpmt? -76.64 134.21 39.37 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.861 0.725 . . . . 0.0 109.59 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 15.6 m -103.79 51.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 121.586 0.708 . . . . 0.0 110.927 -172.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 69.4 mt -63.61 -31.58 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.836 176.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 103.39 0.1 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.983 0.913 . . . . 0.0 110.362 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -175.18 -31.43 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.961 1.305 . . . . 0.0 108.044 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.8 p -57.49 93.73 0.01 OUTLIER 'General case' 0 C--N 1.362 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 111.56 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -70.57 -41.16 72.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.986 0.914 . . . . 0.0 109.776 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -81.09 157.24 25.45 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.33 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -84.12 172.62 11.78 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.713 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.2 153.39 20.41 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.524 0.73 . . . . 0.0 109.282 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.513 ' HA ' ' NE2' ' A' ' 103' ' ' GLN . 24.9 t70 -83.65 65.98 8.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 170.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -104.15 -73.82 0.66 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.151 -1.386 . . . . 0.0 109.907 -170.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -20.89 63.12 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.028 0.531 . . . . 0.0 111.579 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.513 ' NE2' ' HA ' ' A' ' 100' ' ' ASP . 1.0 OUTLIER -59.58 -54.79 42.47 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 171.665 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -28.93 65.46 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.407 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.15 -50.9 43.6 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.453 0.701 . . . . 0.0 111.381 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.18 -41.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.422 0.689 . . . . 0.0 109.943 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.14 74.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.269 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.6 tp -68.54 -41.01 80.47 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.482 0.713 . . . . 0.0 111.542 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -65.56 -41.44 92.95 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.975 0.51 . . . . 0.0 111.367 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -82.44 -15.14 53.67 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.898 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -72.58 -46.98 51.69 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 170.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -84.71 -2.5 57.66 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.33 0.652 . . . . 0.0 112.464 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.2 m -55.16 148.43 30.26 Favored Pre-proline 0 N--CA 1.487 1.384 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.728 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.28 89.65 0.03 OUTLIER 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.84 3.026 . . . . 0.0 112.678 -174.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.485 ' HA ' HH21 ' A' ' 121' ' ' ARG . 4.1 tppp? -74.73 121.36 21.61 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.669 -174.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.512 ' HB ' ' HG3' ' A' ' 121' ' ' ARG . 10.7 tp -99.98 152.37 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -177.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -115.5 -37.69 3.94 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 175.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -173.93 128.13 0.39 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.709 0.804 . . . . 0.0 109.41 177.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 67.94 99.74 0.05 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.683 1.193 . . . . 0.0 111.164 176.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.56 -120.33 0.94 Allowed Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.512 ' HG3' ' HB ' ' A' ' 116' ' ' ILE . 5.0 ppt_? -73.02 -7.18 50.04 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 117.425 0.612 . . . . 0.0 110.808 176.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.2 -28.84 59.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.847 1.259 . . . . 0.0 111.066 167.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 5.4 tt -75.99 79.9 2.86 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.42 -12.39 20.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.493 1.117 . . . . 0.0 108.316 165.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.43 158.08 44.76 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 125.214 1.405 . . . . 0.0 108.409 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 56.4 mtt -118.75 89.27 3.09 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.236 0.614 . . . . 0.0 109.424 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -89.79 131.11 35.91 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -157.97 139.44 13.64 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.722 0.809 . . . . 0.0 109.716 -177.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.39 113.78 27.54 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.972 0.909 . . . . 0.0 109.349 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 8.4 t -95.4 109.91 22.02 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 121.512 0.673 . . . . 0.0 109.85 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 46.3 t -115.58 140.81 48.82 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.859 0.864 . . . . 0.0 109.295 176.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.354 0.661 . . . . 0.0 109.642 -179.017 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.538 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 110.807 -0.071 . . . . 0.0 110.807 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -54.89 -50.51 68.58 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.489 0.716 . . . . 0.0 111.901 -177.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.583 ' HG ' HD23 ' A' ' 25' ' ' LEU . 1.8 pt? -63.91 -36.13 82.93 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.633 1.173 . . . . 0.0 111.923 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.583 HD23 ' HG ' ' A' ' 24' ' ' LEU . 3.8 mm? -63.85 -45.66 88.53 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.246 0.618 . . . . 0.0 110.247 176.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -74.12 -37.23 64.15 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.064 0.853 . . . . 0.0 110.983 -172.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -59.98 -52.48 65.2 Favored 'General case' 0 C--N 1.356 0.852 0 O-C-N 124.008 0.817 . . . . 0.0 109.743 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.475 HD21 ' CD2' ' A' ' 44' ' ' LEU . 13.2 tp -62.0 -45.22 94.58 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.338 1.024 . . . . 0.0 110.954 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -58.3 -39.31 78.99 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.994 0.918 . . . . 0.0 111.583 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.78 -50.78 61.57 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.596 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.0 pt -81.61 -19.77 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.532 HG23 HD11 ' A' ' 58' ' ' LEU . 80.6 p -99.35 -42.77 6.84 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.026 0.53 . . . . 0.0 110.556 178.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.12 -0.05 57.28 Favored Glycine 0 N--CA 1.469 0.849 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.329 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.635 HD12 HD13 ' A' ' 58' ' ' LEU . 95.4 mt -80.42 111.5 17.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.852 0.861 . . . . 0.0 109.524 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -75.04 -34.77 61.9 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.783 0.833 . . . . 0.0 110.527 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -56.51 106.65 0.71 Allowed Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 124.457 1.103 . . . . 0.0 111.241 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.516 ' HA ' HD13 ' A' ' 40' ' ' LEU . 59.8 Cg_endo -68.45 -21.16 40.9 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 122.897 2.398 . . . . 0.0 112.103 -175.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -66.69 -44.64 81.21 Favored 'General case' 0 C--N 1.349 0.579 0 C-N-CA 123.541 0.736 . . . . 0.0 110.862 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.455 ' HB3' HG21 ' A' ' 34' ' ' ILE . 2.0 t80 -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.285 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.516 HD13 ' HA ' ' A' ' 37' ' ' PRO . 47.4 mt -72.21 -42.82 65.32 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.649 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -60.36 -43.13 96.83 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.273 0.629 . . . . 0.0 110.908 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.538 ' HA ' ' HE3' ' A' ' 45' ' ' LYS . 44.3 mt-10 -63.09 -39.03 93.51 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.623 0.769 . . . . 0.0 111.471 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.72 77.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.319 0.648 . . . . 0.0 111.506 174.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.541 ' HG ' HD13 ' A' ' 24' ' ' LEU . 3.5 mm? -66.82 -30.49 70.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.038 0.935 . . . . 0.0 110.753 -179.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.538 ' HE3' ' HA ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -75.1 -40.68 59.79 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.112 0.965 . . . . 0.0 110.108 179.018 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.57 -35.16 80.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.633 0.773 . . . . 0.0 110.365 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 m -91.12 -3.53 57.01 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.473 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 62.59 20.91 12.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.232 1.413 . . . . 0.0 112.607 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 120.93 -5.25 11.36 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 119.426 -0.652 . . . . 0.0 113.483 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -87.17 115.51 24.61 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.443 0.621 . . . . 0.0 111.012 -178.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.0 tp -66.0 -32.28 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 123.916 0.886 . . . . 0.0 111.733 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -66.44 -47.44 73.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.088 0.955 . . . . 0.0 111.786 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -69.13 -38.24 78.75 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 176.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.98 67.63 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 123.794 0.683 . . . . 0.0 111.893 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.53 -39.93 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.86 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -61.97 -31.3 71.63 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.174 0.59 . . . . 0.0 111.854 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.9 mt -83.17 -36.3 24.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.994 0.918 . . . . 0.0 111.518 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.635 HD13 HD12 ' A' ' 34' ' ' ILE . 53.2 mt -73.15 -29.15 62.67 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 177.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.435 ' O ' HG21 ' A' ' 63' ' ' VAL . 46.2 p -77.97 -30.5 50.29 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 122.766 0.427 . . . . 0.0 110.063 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -57.65 -29.98 65.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.624 0.77 . . . . 0.0 111.54 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -53.94 -46.99 71.7 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.933 1.293 . . . . 0.0 111.726 175.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -90.94 -17.26 26.68 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.392 0.677 . . . . 0.0 111.605 -177.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 59' ' ' THR . 87.7 t -67.94 -32.12 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -61.98 98.26 0.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.539 0.736 . . . . 0.0 110.602 174.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.45 150.29 84.64 Favored Pre-proline 0 CA--C 1.56 1.337 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.975 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -77.77 133.65 31.2 Favored 'Cis proline' 0 C--N 1.381 2.279 0 CA-C-N 120.324 1.151 . . . . 0.0 113.188 2.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.8 p -92.6 130.34 38.26 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 172.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.71 168.09 17.34 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 123.579 0.549 . . . . 0.0 111.43 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -78.61 107.44 11.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.4 p -68.5 107.65 2.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.249 177.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.3 m -65.16 152.91 8.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.876 0.87 . . . . 0.0 111.721 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -108.08 102.97 12.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.784 0.834 . . . . 0.0 109.063 174.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.4 t -93.24 145.77 24.19 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.236 0.615 . . . . 0.0 110.983 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.81 134.9 22.89 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.196 0.998 . . . . 0.0 109.771 -178.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -75.69 175.06 11.79 Favored 'Trans proline' 0 C--N 1.377 2.038 0 C-N-CA 122.894 2.396 . . . . 0.0 112.94 -178.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.0 p -65.25 111.26 2.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.256 1.022 . . . . 0.0 111.841 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.07 -38.87 24.25 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.94 0.896 . . . . 0.0 111.415 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 60.5 t -75.92 94.54 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.117 0.567 . . . . 0.0 109.818 -177.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -178.98 6.52 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.491 0.716 . . . . 0.0 111.05 178.117 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -144.14 51.72 0.63 Allowed Glycine 0 C--N 1.338 0.672 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 t -101.01 122.58 43.79 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.281 1.033 . . . . 0.0 109.61 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 78.46 1.42 Allowed 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -112.9 98.99 7.53 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.958 0.903 . . . . 0.0 110.056 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -161.57 99.63 1.15 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 108.75 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.37 107.97 7.43 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.435 0.694 . . . . 0.0 109.227 -179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -140.94 122.33 14.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.73 0.812 . . . . 0.0 109.576 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 85.0 t -105.08 117.87 51.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.502 HD21 ' H ' ' A' ' 88' ' ' LEU . 1.0 OUTLIER -108.13 61.7 0.61 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.508 1.147 . . . . 0.0 108.935 178.598 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -125.52 148.22 48.96 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.912 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.48 ' HB2' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -160.02 159.93 32.65 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.092 0.472 . . . . 0.0 110.354 -174.99 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.4 t -121.26 36.78 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 168.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.48 HG12 ' HB2' ' A' ' 90' ' ' LYS . 39.9 mm -83.59 70.13 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -162.21 104.22 1.13 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.632 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.15 49.49 2.08 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 t -71.8 124.65 25.27 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.202 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -164.93 144.09 6.82 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.773 0.829 . . . . 0.0 109.101 176.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -140.48 148.85 41.74 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.339 0.656 . . . . 0.0 109.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -111.88 126.32 54.98 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 52.6 tptt -64.61 157.48 26.95 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.866 0.866 . . . . 0.0 110.312 179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.2 -16.87 44.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.022 0.529 . . . . 0.0 111.579 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -73.6 -49.36 26.62 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -170.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.37 77.5 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.349 0.522 . . . . 0.0 110.65 176.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -61.74 -50.37 72.67 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.797 0.686 . . . . 0.0 109.98 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.19 -31.81 70.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.6 1.187 . . . . 0.0 111.651 -176.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -72.02 -46.57 56.61 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.599 0.76 . . . . 0.0 111.161 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.9 mm -67.66 -39.3 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.419 0.687 . . . . 0.0 109.596 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.39 97.03 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.09 0.956 . . . . 0.0 111.43 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.37 -40.64 85.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 0.0 109.239 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 t -65.55 -41.29 93.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.297 0.639 . . . . 0.0 111.419 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 39.8 tp -68.3 -52.54 32.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.256 0.622 . . . . 0.0 110.181 -177.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.19 -30.59 69.72 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.383 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 38.81 43.42 0.73 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.944 1.698 . . . . 0.0 112.293 -171.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.0 p -55.44 130.56 70.11 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.288 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.16 125.95 20.89 Favored 'Trans proline' 0 C--N 1.385 2.485 0 C-N-CA 123.108 2.539 . . . . 0.0 111.628 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -86.81 44.58 1.18 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.815 0.846 . . . . 0.0 110.935 -175.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.491 HD13 ' HB2' ' A' ' 123' ' ' LEU . 48.2 mt -72.39 92.29 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.687 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 173.109 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -107.74 77.84 1.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 68.88 -72.37 0.1 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.486 1.514 . . . . 0.0 111.635 -176.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.66 -12.37 57.98 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.479 1.112 . . . . 0.0 113.286 -174.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -84.6 24.1 6.85 Favored Glycine 0 C--N 1.355 1.621 0 CA-C-O 119.531 -0.594 . . . . 0.0 114.011 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 29.5 mmm180 -45.64 -23.14 0.21 Allowed 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 126.335 1.854 . . . . 0.0 114.148 179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.29 -40.38 64.68 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.189 1.396 . . . . 0.0 113.155 -176.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.491 ' HB2' HD13 ' A' ' 116' ' ' ILE . 65.5 mt -97.55 32.68 2.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.613 0.765 . . . . 0.0 111.347 -174.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -63.1 135.75 57.39 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 0.0 110.382 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -74.73 99.46 3.72 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 121.379 0.609 . . . . 0.0 110.629 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 85.4 mtp -89.71 143.81 26.5 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.944 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -162.18 111.02 1.44 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 42.19 23.37 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 125.966 1.706 . . . . 0.0 114.325 -170.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -116.22 78.48 1.2 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.549 1.14 . . . . 0.0 107.994 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 47.3 p -63.07 -53.83 47.55 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.746 -177.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 57.4 p -83.84 116.47 22.76 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.082 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.965 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 . . . . . 0 CA--C 1.556 1.209 0 CA-C-O 120.779 0.323 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ttt -55.2 -43.77 74.74 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.797 0.839 . . . . 0.0 112.64 -170.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.539 ' HG ' HD21 ' A' ' 25' ' ' LEU . 2.3 pt? -62.08 -38.25 88.14 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.539 HD21 ' HG ' ' A' ' 24' ' ' LEU . 3.5 mm? -65.58 -46.15 80.54 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 176.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -64.45 -50.14 68.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.944 -174.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.28 71.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 112.047 -177.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.544 HD11 HD12 ' A' ' 58' ' ' LEU . 2.3 tm? -68.34 -38.07 81.15 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.2 -177.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -65.54 -35.65 81.48 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.178 0.591 . . . . 0.0 110.941 172.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.64 -39.12 92.86 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.58 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.2 pt -96.41 -13.97 7.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.7 p -102.43 -51.83 3.25 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.05 0.841 . . . . 0.0 110.89 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.75 7.22 42.31 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.378 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.626 HD12 HD11 ' A' ' 58' ' ' LEU . 60.6 mt -86.81 123.32 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.03 0.532 . . . . 0.0 110.891 -175.219 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -88.66 -11.63 44.74 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.98 0.912 . . . . 0.0 111.932 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.52 111.74 10.57 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-O 118.653 -0.689 . . . . 0.0 109.702 175.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.88 -36.92 81.31 Favored 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.014 2.476 . . . . 0.0 112.256 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.467 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 55.6 m -62.69 -48.9 77.3 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.577 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -52.76 -40.67 63.36 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.232 1.013 . . . . 0.0 112.127 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 27.6 mt -66.26 -47.87 72.32 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 124.2 0.938 . . . . 0.0 109.788 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -61.19 -42.09 97.96 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.218 175.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 38' ' ' SER . 14.1 mm-40 -69.85 -32.98 71.66 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.356 1.063 . . . . 0.0 110.669 -174.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.87 -46.86 70.52 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 123.975 0.797 . . . . 0.0 110.672 175.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.416 ' HG ' HD13 ' A' ' 24' ' ' LEU . 3.6 mm? -64.31 -34.81 78.99 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.878 0.871 . . . . 0.0 109.939 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 4.1 tmmm? -69.98 -42.21 73.42 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.224 1.01 . . . . 0.0 110.244 178.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.63 -22.19 60.07 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.825 0.85 . . . . 0.0 111.358 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -104.38 5.2 34.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.287 0.635 . . . . 0.0 111.642 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 66.31 17.57 10.73 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.228 1.011 . . . . 0.0 111.529 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.49 -3.36 24.9 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.72 178.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -82.59 111.54 18.67 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.555 0.742 . . . . 0.0 110.087 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.431 HG13 HD21 ' A' ' 28' ' ' LEU . 20.6 tt -74.33 -24.6 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 122.742 0.417 . . . . 0.0 111.915 -174.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.7 m -71.66 -44.81 63.63 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.587 0.755 . . . . 0.0 110.535 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.485 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -71.45 -34.66 70.44 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.119 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -51.72 68.34 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.646 0.778 . . . . 0.0 112.242 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.43 -39.28 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 122.581 0.352 . . . . 0.0 110.741 175.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.2 t -59.82 -31.38 69.68 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.012 0.525 . . . . 0.0 111.719 178.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 88.0 mt -78.92 -41.33 29.76 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.207 0.603 . . . . 0.0 111.552 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.626 HD11 HD12 ' A' ' 34' ' ' ILE . 74.1 mt -76.22 -21.06 56.86 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 42.9 p -84.41 -2.6 57.42 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.879 0.472 . . . . 0.0 111.741 176.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 18.2 t70 -50.59 -28.64 9.1 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.657 1.183 . . . . 0.0 112.855 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -47.2 -49.37 23.02 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.504 1.122 . . . . 0.0 111.866 175.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -100.47 -8.3 23.31 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.981 0.913 . . . . 0.0 112.091 -177.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 86.7 t -74.06 -54.34 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 174.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 60' ' ' ASP . 25.0 pttm -72.74 101.61 3.14 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 122.044 0.926 . . . . 0.0 110.064 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 152.47 51.31 Favored Pre-proline 0 CA--C 1.564 1.486 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 177.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.04 112.07 2.16 Favored 'Cis proline' 0 C--N 1.383 2.347 0 CA-C-N 120.599 1.25 . . . . 0.0 111.61 -6.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.4 m -64.96 -55.22 20.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.646 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -106.67 116.0 31.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -76.85 114.0 15.14 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 123.717 0.636 . . . . 0.0 109.613 178.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.5 t -99.61 170.7 8.4 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.523 0.729 . . . . 0.0 110.121 177.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 m -91.65 168.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.747 0.819 . . . . 0.0 110.349 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -140.74 110.34 6.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.232 0.613 . . . . 0.0 109.967 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.8 m -102.91 87.69 3.0 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 123.507 0.723 . . . . 0.0 109.597 -178.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -83.46 128.73 63.0 Favored Pre-proline 0 CA--C 1.553 1.066 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.226 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -80.27 -165.61 0.35 Allowed 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 123.063 2.509 . . . . 0.0 112.041 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.4 m -65.71 127.97 34.09 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.009 0.524 . . . . 0.0 111.325 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -101.01 -16.49 17.12 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.562 0.745 . . . . 0.0 110.949 -178.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.5 m -67.81 162.44 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 122.69 0.396 . . . . 0.0 111.371 176.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -79.8 162.98 24.78 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.084 0.953 . . . . 0.0 111.356 -177.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -154.2 29.39 0.71 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.721 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.0 p -150.69 -176.35 5.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 110.645 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 72.79 17.97 4.26 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.947 1.299 . . . . 0.0 110.81 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.47 86.83 4.48 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 176.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -84.08 19.33 1.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.114 0.965 . . . . 0.0 112.656 -175.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 pttp 44.22 35.07 1.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 126.299 1.84 . . . . 0.0 113.587 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -122.07 102.47 8.17 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.017 0.927 . . . . 0.0 108.895 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.3 t -82.74 127.43 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -71.76 -36.71 70.48 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.092 0.557 . . . . 0.0 109.632 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.75 145.49 50.42 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.229 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.465 ' HD3' ' HB3' ' A' ' 93' ' ' ASP . 1.3 tpmt? -75.95 145.36 40.42 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 120.936 0.398 . . . . 0.0 110.625 -177.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 15.0 t -98.27 38.8 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 49.4 mt 56.11 77.42 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 125.03 1.332 . . . . 0.0 110.992 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.465 ' HB3' ' HD3' ' A' ' 90' ' ' LYS . 33.0 t70 -111.09 89.55 3.08 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.234 175.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 pp -110.48 26.15 11.0 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.114 0.966 . . . . 0.0 109.751 171.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.3 m -58.6 92.86 0.02 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.857 1.263 . . . . 0.0 111.797 -175.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -136.47 86.11 2.19 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.04 141.22 58.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.121 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -68.92 117.4 10.55 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.732 0.813 . . . . 0.0 110.67 -174.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -92.27 148.54 22.06 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.347 0.659 . . . . 0.0 109.933 177.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -84.55 101.71 12.31 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.334 0.654 . . . . 0.0 109.588 -176.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -129.02 -68.88 0.73 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -26.35 67.74 Favored 'General case' 0 C--N 1.349 0.565 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.225 -178.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -63.49 -55.53 23.3 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.43 -38.51 80.86 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.359 0.664 . . . . 0.0 111.751 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.82 -54.44 38.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.492 0.717 . . . . 0.0 111.807 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.16 -44.68 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.824 0.85 . . . . 0.0 110.583 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 111' ' ' LEU . . . -62.25 -49.53 75.34 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.716 0.806 . . . . 0.0 111.497 -176.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.82 -39.65 83.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.927 0.891 . . . . 0.0 110.228 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -68.07 -44.95 75.17 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.736 0.415 . . . . 0.0 111.148 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt -79.0 -15.74 57.85 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.049 0.54 . . . . 0.0 111.568 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 107' ' ' ALA . 1.9 tm? -74.47 -54.98 6.48 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 172.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -95.88 64.5 2.45 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.531 -176.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.3 m -98.57 153.15 38.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.311 176.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.16 125.81 14.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 122.344 2.029 . . . . 0.0 111.481 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -74.94 -27.89 60.37 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.935 0.494 . . . . 0.0 109.734 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 44.5 mm -54.47 104.37 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.861 0.865 . . . . 0.0 110.117 175.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 122' ' ' ASP . 20.8 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.792 -175.239 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -117.42 -152.66 0.51 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.846 0.858 . . . . 0.0 109.869 178.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -65.41 -66.09 0.59 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.574 0.749 . . . . 0.0 111.766 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -141.45 27.91 2.35 Favored Glycine 0 N--CA 1.474 1.218 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -161.73 178.73 8.72 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.422 1.089 . . . . 0.0 109.035 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.434 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 22.3 m-20 -105.67 -64.58 1.13 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 173.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 98.4 mt -103.79 160.57 14.67 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.176 0.59 . . . . 0.0 110.704 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -148.96 159.41 44.23 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.07 0.948 . . . . 0.0 109.648 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -84.86 86.22 7.38 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.996 0.519 . . . . 0.0 110.445 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 90.7 mtp -113.47 158.22 20.97 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.523 168.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 57.76 72.82 0.5 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.213 1.005 . . . . 0.0 111.167 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.59 7.58 2.34 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 114.467 -1.242 . . . . 0.0 109.656 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -76.84 171.64 14.41 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.489 1.116 . . . . 0.0 111.774 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 4.7 t -145.89 145.53 30.75 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.136 0.574 . . . . 0.0 110.338 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 37.1 t -94.21 104.67 16.67 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.13 0.972 . . . . 0.0 110.57 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.044 173.806 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -63.29 -40.73 98.18 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.024 0.53 . . . . 0.0 111.421 -171.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.485 HD11 ' HG ' ' A' ' 44' ' ' LEU . 2.1 pt? -64.78 -35.14 80.13 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.83 0.852 . . . . 0.0 111.623 177.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.09 -53.24 58.17 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -64.67 -45.54 86.28 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.941 -173.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -61.4 -55.46 31.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.147 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.9 tp -59.76 -47.15 86.81 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 123.472 0.482 . . . . 0.0 110.45 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -53.37 -40.23 64.81 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.694 1.198 . . . . 0.0 111.857 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.76 -46.64 62.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.047 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 pt -89.9 -0.67 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.49 HG22 HD13 ' A' ' 58' ' ' LEU . 74.2 p -108.31 -46.98 3.61 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.682 0.793 . . . . 0.0 109.574 170.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.43 -8.28 40.67 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.467 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.404 HD11 ' HB3' ' A' ' 58' ' ' LEU . 75.0 mt -80.47 117.23 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.115 0.966 . . . . 0.0 110.486 -176.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -83.48 -17.03 43.37 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.224 0.953 . . . . 0.0 111.22 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.72 108.8 2.41 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.116 0.966 . . . . 0.0 109.776 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.74 -30.31 59.35 Favored 'Trans proline' 0 C--N 1.379 2.136 0 C-N-CA 122.725 2.284 . . . . 0.0 112.517 -173.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.504 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 57.3 m -58.48 -52.59 64.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.018 0.527 . . . . 0.0 110.433 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -51.68 -35.08 41.2 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.303 1.041 . . . . 0.0 112.046 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.545 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.5 mt -70.96 -45.98 63.18 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 123.802 0.689 . . . . 0.0 110.643 -177.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -66.48 -37.02 84.18 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.712 0.405 . . . . 0.0 111.379 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 38' ' ' SER . 18.5 mm-40 -64.22 -46.21 84.86 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.226 1.01 . . . . 0.0 110.765 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -41.1 96.69 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.63 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.485 ' HG ' HD11 ' A' ' 24' ' ' LEU . 3.3 mm? -69.74 -37.49 76.48 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.387 0.675 . . . . 0.0 111.524 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' HZ3' ' HB3' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -74.26 -36.57 63.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.433 0.293 . . . . 0.0 110.521 -176.944 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.574 ' HA ' ' HG3' ' A' ' 75' ' ' PRO . . . -77.64 -22.02 51.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.242 0.617 . . . . 0.0 111.804 -177.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.6 p -94.96 3.13 55.3 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.234 0.614 . . . . 0.0 111.795 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 75.92 -18.7 0.45 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 125.084 1.354 . . . . 0.0 112.004 -175.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 140.05 -7.16 2.91 Favored Glycine 0 C--N 1.343 0.929 0 N-CA-C 111.971 -0.452 . . . . 0.0 111.971 -172.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -78.23 107.27 10.72 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.038 0.535 . . . . 0.0 110.558 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.456 ' O ' HG23 ' A' ' 55' ' ' VAL . 13.3 tt -66.98 -26.63 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.5 m -67.03 -50.22 62.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.397 0.618 . . . . 0.0 110.207 177.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.406 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 16.5 mm100 -61.99 -36.06 80.36 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.612 176.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.75 90.94 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 123.758 0.823 . . . . 0.0 111.7 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -59.97 -45.48 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 173.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -58.71 -35.59 72.9 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.724 0.809 . . . . 0.0 111.756 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.3 mt -71.63 -40.03 70.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.31 0.644 . . . . 0.0 111.034 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.49 HD13 HG22 ' A' ' 32' ' ' THR . 51.9 mt -75.61 -25.15 56.71 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p -84.28 -18.69 35.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.463 0.305 . . . . 0.0 110.441 174.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.87 -35.5 76.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.486 0.715 . . . . 0.0 109.596 174.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -52.69 -44.63 66.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.141 1.376 . . . . 0.0 113.576 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -80.81 -3.26 50.44 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.232 0.613 . . . . 0.0 112.281 -173.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.3 p -139.81 30.58 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.284 0 CA-C-O 122.429 1.109 . . . . 0.0 109.543 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -84.8 5.23 29.45 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.375 1.07 . . . . 0.0 112.475 -170.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -106.14 159.8 28.41 Favored Pre-proline 0 CA--C 1.562 1.418 0 C-N-CA 124.146 0.978 . . . . 0.0 110.481 178.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -78.81 -45.02 0.44 Allowed 'Cis proline' 0 C--N 1.384 2.402 0 CA-C-N 120.791 1.318 . . . . 0.0 112.542 -4.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.0 t -133.23 81.12 1.92 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.0 mm-40 -107.59 59.28 0.62 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.85 107.3 0.38 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.867 -168.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 82.8 p -95.88 -174.6 3.17 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.953 0.901 . . . . 0.0 109.885 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.2 t -76.07 95.09 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 168.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -73.81 -12.42 60.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.76 0.824 . . . . 0.0 112.315 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.7 t -94.33 159.48 15.1 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 171.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -87.13 148.88 46.11 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 123.032 0.533 . . . . 0.0 110.995 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . 0.574 ' HG3' ' HA ' ' A' ' 46' ' ' ALA . 38.8 Cg_endo -65.31 128.94 21.47 Favored 'Trans proline' 0 C--N 1.379 2.157 0 C-N-CA 122.354 2.036 . . . . 0.0 109.599 167.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.9 p -69.73 82.83 0.45 Allowed 'General case' 0 CA--C 1.548 0.869 0 CA-C-O 121.703 0.763 . . . . 0.0 111.028 -176.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.8 -26.57 65.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.969 175.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.4 m -116.33 144.47 23.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.81 0 C-N-CA 124.392 1.077 . . . . 0.0 109.541 176.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -108.39 146.67 32.7 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 124.303 1.041 . . . . 0.0 108.924 177.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.01 42.3 9.67 Favored Glycine 0 C--N 1.343 0.949 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -173.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.2 p -67.07 109.21 2.92 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.742 0.817 . . . . 0.0 110.753 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -85.9 62.62 7.57 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.672 0.789 . . . . 0.0 109.663 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -86.8 128.83 35.05 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.579 0.752 . . . . 0.0 109.291 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -63.97 100.62 0.32 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.835 0.854 . . . . 0.0 110.117 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.65 104.47 7.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 -177.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -97.51 164.22 12.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.434 0.694 . . . . 0.0 110.752 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.45 106.78 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -86.67 80.06 8.68 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.41 -168.39 1.48 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.95 0.9 . . . . 0.0 109.823 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -160.29 142.37 12.87 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.5 p -102.45 -9.18 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 123.153 0.581 . . . . 0.0 111.476 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.2 mt -72.79 -28.45 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.337 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.43 ' HB3' HG23 ' A' ' 95' ' ' THR . 8.9 m-20 -57.96 113.35 1.84 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.398 0.679 . . . . 0.0 110.141 172.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 pp -79.98 9.97 4.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.616 0.766 . . . . 0.0 112.021 -178.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.43 HG23 ' HB3' ' A' ' 93' ' ' ASP . 6.2 t -58.0 87.78 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.361 1.064 . . . . 0.0 112.926 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 p-80 179.23 150.62 0.31 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.945 1.698 . . . . 0.0 107.968 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -87.76 161.9 17.33 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -74.52 155.65 37.72 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.988 0.515 . . . . 0.0 110.151 174.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.558 ' HB3' ' HZ1' ' A' ' 99' ' ' LYS . 0.4 OUTLIER -72.21 168.44 18.25 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.763 173.389 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.64 -15.03 57.6 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.101 0.56 . . . . 0.0 111.966 -176.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -63.46 -66.21 0.57 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.613 0.765 . . . . 0.0 111.808 -173.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -29.35 70.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.979 0.512 . . . . 0.0 111.646 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -64.31 -52.71 57.18 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.091 0.556 . . . . 0.0 110.944 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.64 -30.23 68.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.323 0.649 . . . . 0.0 111.498 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.88 -54.69 30.83 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.714 0.806 . . . . 0.0 110.941 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -70.76 -36.78 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.471 0.708 . . . . 0.0 110.773 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.35 -38.91 92.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.828 0.851 . . . . 0.0 111.123 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 52.3 tp -70.94 -41.19 71.48 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.7 m -63.58 -29.58 70.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.851 0.46 . . . . 0.0 111.259 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 56.5 tp -74.62 -41.01 61.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.171 0.989 . . . . 0.0 109.874 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 tt -67.78 -39.84 84.02 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.892 0.877 . . . . 0.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -96.38 13.61 27.18 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.851 0.861 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.2 t -67.63 130.84 93.01 Favored Pre-proline 0 N--CA 1.474 0.748 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -62.26 145.92 95.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 122.772 2.315 . . . . 0.0 112.215 -174.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -83.57 70.18 10.23 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.145 0.974 . . . . 0.0 109.223 -177.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 47.9 mm -96.14 116.95 39.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.933 -177.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -93.11 45.4 1.17 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.191 0.996 . . . . 0.0 109.416 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.4 -170.69 0.85 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.939 1.296 . . . . 0.0 110.249 -175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -86.0 -21.27 27.89 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.561 0.744 . . . . 0.0 111.593 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -170.5 76.01 0.1 Allowed Glycine 0 C--N 1.351 1.386 0 N-CA-C 111.829 -0.508 . . . . 0.0 111.829 -177.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 64.02 153.64 0.05 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.545 1.538 . . . . 0.0 112.377 -173.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -165.7 -69.2 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.312 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 52.9 tp -74.59 107.8 6.94 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.772 -177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -139.19 133.46 31.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -122.97 78.05 1.51 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.301 0.64 . . . . 0.0 109.642 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.7 mtm 46.43 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 125.757 1.623 . . . . 0.0 114.696 164.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -56.77 -36.73 70.17 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.228 0.611 . . . . 0.0 110.343 174.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.82 93.5 1.69 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.086 170.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.15 114.32 15.84 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 175.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.3 p -71.57 128.25 35.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.009 0.524 . . . . 0.0 109.997 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 27.1 p -70.33 85.09 0.58 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.741 0.816 . . . . 0.0 110.088 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 C-N-CA 124.242 1.017 . . . . 0.0 108.707 -176.585 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 . . . . . 0 CA--C 1.555 1.138 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -36.38 76.34 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.677 0.791 . . . . 0.0 112.182 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.518 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.4 pt? -66.26 -39.43 89.46 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.589 0.756 . . . . 0.0 111.12 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.518 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -66.98 -46.94 73.07 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.12 0.568 . . . . 0.0 110.188 177.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -62.16 -52.05 65.4 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.64 1.213 . . . . 0.0 110.968 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -58.42 -53.7 55.4 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.204 0.94 . . . . 0.0 111.043 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.426 HD12 HD21 ' A' ' 40' ' ' LEU . 2.1 tm? -56.24 -50.75 70.41 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.259 0.974 . . . . 0.0 110.027 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.45 ' HB2' HD12 ' A' ' 40' ' ' LEU . 72.4 ttt180 -61.14 -33.73 73.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.117 0.967 . . . . 0.0 111.952 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -74.12 -40.41 62.69 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.568 0.747 . . . . 0.0 110.723 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 pt -95.18 -15.5 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.589 -169.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.9 p -96.36 -43.13 7.8 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.95 -4.69 61.18 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.868 -177.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.48 HD12 HD13 ' A' ' 58' ' ' LEU . 62.5 mt -75.3 120.36 24.81 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 123.756 0.822 . . . . 0.0 109.443 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -86.43 -17.55 34.01 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.57 0.748 . . . . 0.0 111.353 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -70.16 109.48 4.93 Favored Pre-proline 0 N--CA 1.483 1.18 0 C-N-CA 123.544 0.738 . . . . 0.0 110.205 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.6 -25.46 79.3 Favored 'Trans proline' 0 C--N 1.388 2.637 0 C-N-CA 123.217 2.611 . . . . 0.0 113.255 -175.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m -58.36 -51.74 68.54 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.662 0.601 . . . . 0.0 110.555 177.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.15 -36.46 79.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.733 0.813 . . . . 0.0 111.423 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.45 HD12 ' HB2' ' A' ' 29' ' ' ARG . 13.9 mt -68.2 -56.67 7.88 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 124.386 1.054 . . . . 0.0 109.521 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -59.86 -50.19 74.75 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.117 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -56.68 -40.21 75.15 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.568 0.747 . . . . 0.0 111.903 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.8 87.3 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.739 0.65 . . . . 0.0 110.873 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.413 HD21 ' O ' ' A' ' 40' ' ' LEU . 4.3 mm? -69.35 -23.53 63.78 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.825 0.85 . . . . 0.0 111.888 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -47.94 17.87 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.31 86.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 124.228 0.955 . . . . 0.0 110.943 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.9 m -89.58 -3.29 58.37 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.778 0.831 . . . . 0.0 111.908 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.424 HD21 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER 64.2 21.94 12.7 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.69 1.196 . . . . 0.0 112.47 176.256 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.26 -8.56 24.79 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-O 119.675 -0.514 . . . . 0.0 113.218 178.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.06 111.86 13.09 Favored 'General case' 0 C--O 1.246 0.918 0 CA-C-N 117.329 0.564 . . . . 0.0 110.519 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.44 ' O ' HG23 ' A' ' 55' ' ' VAL . 5.7 tp -65.98 -34.46 70.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 C-N-CA 123.268 0.627 . . . . 0.0 111.351 -173.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 35.7 m -66.65 -49.97 64.47 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.823 0.849 . . . . 0.0 110.866 -173.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -64.28 -39.94 94.96 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.259 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.88 -52.89 59.05 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.071 0.857 . . . . 0.0 112.317 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.9 t -63.73 -44.0 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 122.973 0.509 . . . . 0.0 110.433 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 t -58.5 -43.67 89.15 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 124.261 0.976 . . . . 0.0 111.187 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.16 -30.23 62.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.957 -176.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.48 HD13 HD12 ' A' ' 34' ' ' ILE . 72.8 mt -72.33 -40.71 67.21 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.6 p -80.94 -11.19 59.62 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.868 0.467 . . . . 0.0 111.62 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.99 -21.87 61.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.768 0.827 . . . . 0.0 112.393 -178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -57.56 -37.96 74.0 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.756 0.822 . . . . 0.0 112.672 -177.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.1 ptt85 -87.61 -19.68 27.44 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.821 0.848 . . . . 0.0 110.71 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.0 t -79.38 -30.49 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.493 0.717 . . . . 0.0 109.145 177.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.59 102.63 0.93 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.132 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.478 ' HA ' ' N ' ' A' ' 67' ' ' SER . 44.0 mt-10 -65.4 150.82 95.34 Favored Pre-proline 0 CA--C 1.554 1.107 0 C-N-CA 123.833 0.853 . . . . 0.0 111.914 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.11 109.1 0.86 Allowed 'Cis proline' 0 C--N 1.389 2.702 0 CA-C-N 120.255 1.127 . . . . 0.0 113.454 5.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.478 ' N ' ' HA ' ' A' ' 65' ' ' GLU . 49.6 m -76.97 108.13 9.8 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 123.953 0.901 . . . . 0.0 109.758 -179.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -152.23 148.67 27.84 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.604 1.161 . . . . 0.0 108.477 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 58.83 26.49 14.88 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.11 0.964 . . . . 0.0 110.674 -177.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.5 p -74.34 104.8 5.23 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 123.984 0.914 . . . . 0.0 110.637 -172.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.5 m -59.86 141.09 17.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.762 0.825 . . . . 0.0 111.044 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 89.93 0.29 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 0.0 110.527 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.1 m -124.64 54.1 1.41 Allowed 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.363 1.065 . . . . 0.0 108.338 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -100.78 144.77 29.17 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.264 -175.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -75.87 179.58 6.14 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.417 2.078 . . . . 0.0 111.348 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -80.03 70.67 6.66 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -83.58 82.46 8.29 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-O 121.799 0.809 . . . . 0.0 109.109 -175.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.7 m -93.13 176.32 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.746 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.45 109.82 7.26 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.26 87.11 0.14 Allowed Glycine 0 C--N 1.348 1.198 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.101 -178.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.7 t -59.33 93.98 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.095 0.958 . . . . 0.0 110.663 -178.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.68 74.92 7.49 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.286 1.035 . . . . 0.0 109.777 -174.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.73 141.14 53.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.872 174.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -61.94 -18.99 62.22 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.259 1.024 . . . . 0.0 112.798 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -91.81 73.52 5.74 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-O 121.751 0.786 . . . . 0.0 109.824 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -133.76 112.73 11.61 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.999 -1.001 . . . . 0.0 108.976 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.22 120.43 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -79.46 -30.37 42.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.793 0.437 . . . . 0.0 110.493 -178.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.23 127.05 31.52 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.349 0.66 . . . . 0.0 110.379 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -77.19 135.57 38.51 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.929 0.492 . . . . 0.0 111.03 -172.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.2 t -109.7 28.16 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-O 122.384 1.088 . . . . 0.0 109.071 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 mt -113.94 30.99 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 176.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -67.53 101.72 1.04 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.037 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.02 -16.26 15.85 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.508 0.723 . . . . 0.0 110.718 177.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.1 p -81.56 69.5 8.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.044 0.938 . . . . 0.0 111.407 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -92.61 -59.58 2.03 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.551 -178.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -96.05 43.85 1.08 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 122.47 1.129 . . . . 0.0 109.009 176.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -126.43 120.8 30.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -70.28 156.26 39.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.359 0.664 . . . . 0.0 109.722 174.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -77.96 73.84 4.52 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.716 0.769 . . . . 0.0 109.016 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -140.93 -72.1 0.35 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.323 -175.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -32.1 73.42 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.225 0.61 . . . . 0.0 110.365 175.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -62.82 -56.92 13.15 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.794 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.75 -33.31 75.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 124.095 0.872 . . . . 0.0 111.421 -176.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.05 -59.62 4.24 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.427 0.691 . . . . 0.0 111.517 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.46 -41.19 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.468 0.707 . . . . 0.0 110.776 -176.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.82 -42.55 90.47 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.258 0.623 . . . . 0.0 111.799 -178.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.34 -40.91 77.27 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.6 t -62.55 -43.89 97.69 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.502 0.721 . . . . 0.0 111.332 179.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.59 -47.78 45.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.788 0.835 . . . . 0.0 109.786 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 38.8 tp -71.83 -17.98 62.11 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.644 0.778 . . . . 0.0 110.926 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 47.29 36.22 4.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 126.379 1.871 . . . . 0.0 111.879 -177.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -143.84 139.57 16.27 Favored Pre-proline 0 C--O 1.24 0.596 0 CA-C-N 114.189 -1.369 . . . . 0.0 108.713 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.4 162.1 1.56 Allowed 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 123.592 2.861 . . . . 0.0 114.359 177.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.5 OUTLIER -67.66 -19.25 65.17 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.374 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.5 mt -96.07 139.36 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.91 0.884 . . . . 0.0 109.395 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -101.3 -55.32 2.57 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 161.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.98 -57.81 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.668 172.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -65.57 -16.35 63.62 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.03 -175.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.93 -28.87 73.96 Favored Glycine 0 C--N 1.355 1.631 0 C-N-CA 123.1 0.381 . . . . 0.0 113.238 -178.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 59.76 23.68 12.59 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.573 1.149 . . . . 0.0 112.424 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -90.18 46.22 1.33 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.195 0.998 . . . . 0.0 109.698 -174.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.97 98.27 0.94 Allowed 'General case' 0 C--N 1.355 0.806 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.093 -176.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -165.29 124.67 1.77 Allowed 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -148.63 29.79 0.83 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.1 mmt -92.14 158.26 16.28 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.557 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -71.77 143.13 49.67 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.696 0.398 . . . . 0.0 110.292 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -21.98 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.969 0.508 . . . . 0.0 111.049 173.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -84.44 116.86 23.3 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.006 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 60.7 m -67.99 -41.58 82.08 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.535 0.734 . . . . 0.0 110.268 176.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 54.6 p -79.79 125.78 30.12 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.162 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.002 0 C-N-CA 123.492 0.717 . . . . 0.0 109.913 178.126 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 120.914 0.388 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -56.61 -32.72 65.56 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.358 1.063 . . . . 0.0 113.136 -173.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -61.08 -46.44 90.62 Favored 'General case' 0 C--O 1.253 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 111.072 -178.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.502 HD23 ' HB2' ' A' ' 40' ' ' LEU . 44.3 mt -74.32 -42.58 59.23 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.817 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -62.92 -42.48 99.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.056 0.847 . . . . 0.0 111.247 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.472 ' O ' HG12 ' A' ' 31' ' ' ILE . 13.5 mm100 -63.26 -57.99 8.63 Favored 'General case' 0 C--N 1.356 0.851 0 CA-C-O 118.681 -0.676 . . . . 0.0 110.188 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.466 ' HB3' HD22 ' A' ' 40' ' ' LEU . 16.8 mt -51.49 -53.23 39.53 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 123.979 0.799 . . . . 0.0 111.387 176.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -53.14 -38.66 62.9 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.567 1.147 . . . . 0.0 112.162 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.49 -51.66 33.8 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.287 0.635 . . . . 0.0 110.846 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 27' ' ' GLN . 4.6 pt -91.28 4.03 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -172.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.456 HG22 HD11 ' A' ' 58' ' ' LEU . 45.3 p -122.1 -38.62 2.68 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.432 0.693 . . . . 0.0 110.344 175.283 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.94 -1.68 63.42 Favored Glycine 0 N--CA 1.475 1.287 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.488 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.421 ' HB ' HD23 ' A' ' 40' ' ' LEU . 86.0 mt -79.73 117.31 25.26 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 123.77 0.828 . . . . 0.0 109.922 -178.425 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -81.97 -18.6 42.9 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.739 0.649 . . . . 0.0 110.694 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 5.5 m-20 -68.77 104.88 0.81 Allowed Pre-proline 0 N--CA 1.481 1.076 0 C-N-CA 123.991 0.916 . . . . 0.0 109.747 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.71 -25.31 34.0 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.648 2.232 . . . . 0.0 111.799 -174.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.418 ' O ' ' HG3' ' A' ' 42' ' ' GLU . 42.8 m -66.61 -42.58 86.61 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.909 0.884 . . . . 0.0 110.806 177.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -66.08 -38.67 88.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.874 0.87 . . . . 0.0 109.821 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.502 ' HB2' HD23 ' A' ' 25' ' ' LEU . 56.5 mt -64.58 -41.42 96.27 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.604 175.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -62.5 -44.67 95.82 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 38' ' ' SER . 52.4 mt-10 -61.16 -37.87 84.44 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.587 0.555 . . . . 0.0 111.339 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.39 -48.15 62.04 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.786 0.679 . . . . 0.0 110.994 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.444 HD23 HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.38 -40.62 78.55 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.397 1.079 . . . . 0.0 110.35 179.284 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.66 -37.04 59.93 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.295 1.038 . . . . 0.0 111.722 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -15.75 62.88 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.686 0.394 . . . . 0.0 111.547 178.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -106.94 11.27 30.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.853 0.861 . . . . 0.0 110.982 177.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 65.82 15.79 10.2 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.489 1.116 . . . . 0.0 112.827 175.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.15 -0.34 28.31 Favored Glycine 0 C--N 1.341 0.83 0 C-N-CA 123.36 0.505 . . . . 0.0 112.343 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -83.55 110.4 18.19 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 123.182 0.593 . . . . 0.0 111.078 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.564 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.1 tp -56.34 -38.71 56.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.707 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -58.43 -60.02 4.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.75 1.22 . . . . 0.0 112.279 -173.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.429 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 mm100 -66.93 -28.57 68.4 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.286 178.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.42 93.05 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.34 0.4 . . . . 0.0 111.019 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 51' ' ' ILE . 20.5 t -60.09 -46.99 93.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.131 0 O-C-N 123.762 0.664 . . . . 0.0 109.306 175.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.3 t -53.65 -50.41 65.82 Favored 'General case' 0 C--N 1.354 0.8 0 O-C-N 124.609 1.193 . . . . 0.0 111.683 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 89.3 mt -60.47 -44.13 96.22 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.689 0.618 . . . . 0.0 111.336 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.456 HD11 HG22 ' A' ' 32' ' ' THR . 71.6 mt -73.26 -30.88 63.74 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.434 ' O ' HG13 ' A' ' 63' ' ' VAL . 42.9 p -78.0 -26.64 48.69 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -77.57 -13.01 60.02 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.98 0.512 . . . . 0.0 111.0 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.36 51.82 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.793 0.437 . . . . 0.0 110.95 174.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -70.6 -38.17 73.97 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 59' ' ' THR . 13.3 p -112.26 49.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-O 122.731 1.253 . . . . 0.0 108.803 179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -75.61 92.66 2.96 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.09 -176.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.15 133.34 94.64 Favored Pre-proline 0 CA--C 1.559 1.318 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.569 -177.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -86.96 142.43 25.44 Favored 'Cis proline' 0 C--N 1.378 2.086 0 C-N-CA 124.708 -0.955 . . . . 0.0 112.433 -5.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.2 m -108.63 28.42 8.41 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.217 0.607 . . . . 0.0 110.144 176.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 65.38 13.36 8.77 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.27 1.428 . . . . 0.0 112.559 -176.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -107.5 -159.23 0.68 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.53 0.732 . . . . 0.0 109.81 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -95.97 35.71 1.38 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.066 0.547 . . . . 0.0 112.389 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.05 97.86 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.033 0.444 . . . . 0.0 110.043 173.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.45 74.72 4.98 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 9.8 t -88.35 150.67 23.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.564 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -95.84 150.29 37.16 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 124.401 1.08 . . . . 0.0 109.219 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.25 115.3 4.1 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.071 1.847 . . . . 0.0 109.749 174.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.0 t -51.41 117.92 2.95 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.751 0.82 . . . . 0.0 110.795 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -72.46 83.25 1.09 Allowed 'General case' 0 C--N 1.358 0.958 0 CA-C-O 121.869 0.842 . . . . 0.0 110.43 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.0 p -163.96 112.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.305 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -74.13 90.04 2.01 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.301 0.572 . . . . 0.0 109.823 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.96 51.59 3.19 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.688 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.9 m -147.81 127.04 12.97 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.111 0.965 . . . . 0.0 109.474 -176.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -150.84 6.91 0.53 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.792 0.837 . . . . 0.0 111.097 176.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.44 99.72 6.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.341 0.656 . . . . 0.0 110.184 -178.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -72.82 142.35 48.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.586 0.754 . . . . 0.0 110.238 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -142.99 107.47 4.8 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.34 0.656 . . . . 0.0 109.611 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.51 126.57 26.11 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.476 0.711 . . . . 0.0 110.014 179.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 43.2 t -77.7 125.11 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 77.6 mt -88.4 11.29 17.28 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.308 0.643 . . . . 0.0 112.125 -174.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.76 -177.64 6.76 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.792 0.837 . . . . 0.0 110.638 174.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.456 ' HE3' ' N ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -164.06 155.92 16.62 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.877 0.871 . . . . 0.0 109.985 179.806 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.4 m -109.89 33.87 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.365 1.066 . . . . 0.0 110.443 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.4 mt -86.85 76.22 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.178 0.99 . . . . 0.0 109.125 -175.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.94 133.61 37.2 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.553 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.87 -5.86 5.65 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.24 1.016 . . . . 0.0 111.106 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.8 p -76.91 106.21 8.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.309 0.643 . . . . 0.0 110.664 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -115.57 132.22 56.69 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -80.93 168.91 18.2 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.148 0.579 . . . . 0.0 111.855 -175.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -77.76 148.56 34.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.797 177.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.6 tptt -119.41 157.92 27.25 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -65.46 0.33 1.58 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.946 1.698 . . . . 0.0 114.366 -171.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -56.78 -67.44 0.31 Allowed 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 118.594 0.634 . . . . 0.0 111.301 -176.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -23.23 41.01 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.693 -177.033 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -59.64 -55.83 29.45 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.64 -31.44 68.37 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.337 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.09 -56.53 21.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.861 0.464 . . . . 0.0 111.134 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.47 -43.35 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.011 0.524 . . . . 0.0 110.776 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.67 68.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.916 0.887 . . . . 0.0 111.639 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.88 -41.19 75.12 Favored 'General case' 0 C--N 1.351 0.646 0 O-C-N 123.758 0.661 . . . . 0.0 111.331 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.8 m -64.61 -31.02 72.05 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 123.369 0.418 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.14 -33.43 33.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.821 0.848 . . . . 0.0 109.672 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.0 tp -74.21 -36.29 63.95 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.343 1.057 . . . . 0.0 111.34 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -88.52 -176.38 5.28 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.763 0.792 . . . . 0.0 110.904 -175.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.2 m -130.72 100.33 17.81 Favored Pre-proline 0 C--O 1.244 0.79 0 N-CA-C 104.935 -2.246 . . . . 0.0 104.935 171.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' PRO . . . . . 0.414 ' HG2' HE21 ' A' ' 117' ' ' GLN . 5.0 Cg_endo -45.6 146.5 3.51 Favored 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 124.137 3.224 . . . . 0.0 113.514 -172.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -24.46 7.77 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.666 1.187 . . . . 0.0 113.371 -170.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.415 ' HA ' ' HA3' ' A' ' 120' ' ' GLY . 3.5 mt -78.34 -147.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.866 0 C-N-CA 124.476 1.111 . . . . 0.0 108.179 177.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.414 HE21 ' HG2' ' A' ' 114' ' ' PRO . 68.3 mt-30 65.34 -70.28 0.09 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.255 1.422 . . . . 0.0 111.791 -173.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -109.72 -69.21 0.87 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.868 0.867 . . . . 0.0 111.322 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -90.78 19.57 5.4 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.911 0.884 . . . . 0.0 113.108 -166.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLY . . . . . 0.415 ' HA3' ' HA ' ' A' ' 116' ' ' ILE . . . -129.49 -67.67 0.11 Allowed Glycine 0 C--N 1.348 1.197 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 54.5 75.62 0.28 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.693 1.197 . . . . 0.0 110.682 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -151.11 103.09 3.0 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 123.992 0.917 . . . . 0.0 109.004 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -129.28 58.65 1.61 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.253 1.021 . . . . 0.0 108.547 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -66.06 92.99 0.18 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.103 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -132.39 -49.15 0.91 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' MET . . . . . 0.433 ' SD ' ' N ' ' A' ' 126' ' ' MET . 0.0 OUTLIER -80.91 100.66 8.99 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 113.983 -1.462 . . . . 0.0 108.714 171.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -88.76 145.11 25.81 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.682 -0.636 . . . . 0.0 110.141 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -91.97 147.4 22.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.01 0.524 . . . . 0.0 110.077 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 62.98 26.83 15.69 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.916 1.286 . . . . 0.0 112.154 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -69.96 105.02 2.69 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.409 0.684 . . . . 0.0 110.737 -177.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.0 t -142.77 -173.27 3.84 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.263 1.025 . . . . 0.0 108.471 177.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.632 0 C-N-CA 123.413 0.685 . . . . 0.0 110.624 -177.201 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 54.7 ttm . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.541 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.6 pt? -63.42 -37.26 86.59 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.243 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 40' ' ' LEU . 3.0 mm? -68.17 -44.48 75.83 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -65.84 -46.87 76.93 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.244 0.965 . . . . 0.0 111.044 -176.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.411 ' O ' HG12 ' A' ' 31' ' ' ILE . 24.7 mm-40 -59.63 -56.42 22.12 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 124.699 1.249 . . . . 0.0 110.858 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 40' ' ' LEU . 18.7 tp -56.98 -48.26 78.83 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 124.095 0.872 . . . . 0.0 110.868 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -55.1 -41.93 72.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.751 0.82 . . . . 0.0 111.434 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.55 -44.05 83.42 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.234 1.014 . . . . 0.0 109.948 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.7 pt -97.66 2.26 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -171.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.536 HG21 HD12 ' A' ' 58' ' ' LEU . 68.0 p -114.11 -49.6 2.85 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 170.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 111.69 -10.59 27.87 Favored Glycine 0 C--N 1.338 0.68 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.784 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.717 HD12 HD13 ' A' ' 58' ' ' LEU . 90.5 mt -71.32 119.86 18.41 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 C-N-CA 123.399 0.68 . . . . 0.0 110.652 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -86.37 -20.63 27.99 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.139 0.976 . . . . 0.0 111.685 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.8 t70 -70.81 114.46 26.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.194 0.598 . . . . 0.0 110.405 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.08 -30.52 65.83 Favored 'Trans proline' 0 C--N 1.382 2.299 0 C-N-CA 122.735 2.29 . . . . 0.0 113.24 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.5 t -68.66 -43.13 76.87 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.746 0.419 . . . . 0.0 110.114 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -32.09 70.92 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.524 1.129 . . . . 0.0 110.662 -179.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.5 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 mt -70.42 -48.72 54.75 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.587 178.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -55.43 -47.01 76.63 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.838 173.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.33 -28.48 67.19 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.553 0.741 . . . . 0.0 111.932 -173.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -68.98 -46.68 67.46 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 123.541 0.526 . . . . 0.0 110.831 172.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.541 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.0 mm? -61.68 -31.54 71.68 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.717 0.807 . . . . 0.0 110.632 175.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -74.52 -38.36 62.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.8 0.84 . . . . 0.0 110.758 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.15 -33.11 69.74 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.62 0.768 . . . . 0.0 111.036 -178.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.1 p -91.03 2.2 56.5 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.936 0.894 . . . . 0.0 111.474 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 66.8 t30 63.21 16.79 9.69 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.657 1.183 . . . . 0.0 111.946 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 125.92 -25.45 5.54 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.395 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -74.86 106.86 6.59 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.306 0.553 . . . . 0.0 110.536 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.457 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.8 tt -68.89 -27.9 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.055 0.542 . . . . 0.0 112.079 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -66.66 -46.33 76.05 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.469 0.707 . . . . 0.0 110.637 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.429 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.5 mm-40 -62.52 -37.28 85.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.612 173.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.66 87.87 Favored 'General case' 0 C--O 1.244 0.763 0 C-N-CA 123.523 0.729 . . . . 0.0 111.001 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.1 t -60.8 -51.24 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 123.709 0.631 . . . . 0.0 110.165 174.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -55.04 -39.32 69.02 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 124.386 1.054 . . . . 0.0 111.538 -177.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 91.8 mt -73.4 -37.07 66.07 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.399 -178.196 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.717 HD13 HD12 ' A' ' 34' ' ' ILE . 50.0 mt -74.11 -33.36 63.56 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 120.55 0.214 . . . . 0.0 111.484 177.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.4 p . . . . . 0 CA--C 1.546 0.796 0 C-N-CA 123.096 0.558 . . . . 0.0 111.175 -179.603 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 C--O 1.243 0.738 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -29.04 64.94 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.07 0.395 . . . . 0.0 111.0 -177.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -64.19 -52.68 57.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.025 0.53 . . . . 0.0 110.468 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.01 -23.22 61.36 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.156 0.91 . . . . 0.0 111.4 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.38 -52.98 21.88 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.939 0.496 . . . . 0.0 111.025 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.8 mm -64.01 -43.23 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.718 0.807 . . . . 0.0 109.611 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.74 -41.71 95.91 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.03 0.932 . . . . 0.0 110.911 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 tt -66.16 -44.82 82.99 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.861 0.865 . . . . 0.0 110.213 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -64.39 -34.4 78.08 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.489 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.549 0.925 0 C-N-CA 123.203 0.601 . . . . 0.0 110.869 178.33 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.59 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.5 pt? -70.48 -38.16 74.35 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.659 0.784 . . . . 0.0 111.926 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.59 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.0 mm? -65.67 -53.19 44.54 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.824 0.449 . . . . 0.0 110.072 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -65.05 -41.41 95.19 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.968 1.418 . . . . 0.0 111.66 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -57.83 -51.49 69.38 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.802 0.441 . . . . 0.0 110.125 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.455 HD22 ' CD2' ' A' ' 44' ' ' LEU . 14.4 tp -63.08 -37.32 86.72 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 123.697 0.623 . . . . 0.0 110.821 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 20.2 ttp180 -63.02 -39.34 94.46 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.147 0.979 . . . . 0.0 110.62 -176.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.56 -20.18 34.27 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.422 -177.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.454 HG12 ' HA ' ' A' ' 28' ' ' LEU . 17.1 pt -99.4 -8.32 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 176.07 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.476 HG21 HD12 ' A' ' 58' ' ' LEU . 69.2 p -108.54 -48.12 3.38 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.06 0.544 . . . . 0.0 110.675 174.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.84 -16.44 28.24 Favored Glycine 0 N--CA 1.467 0.74 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.81 -175.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.678 HD12 HD13 ' A' ' 58' ' ' LEU . 57.0 mt -72.68 107.23 3.26 Favored 'Isoleucine or valine' 0 C--N 1.357 0.91 0 C-N-CA 124.039 0.935 . . . . 0.0 110.238 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -78.77 -1.69 35.95 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.025 0.93 . . . . 0.0 111.793 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -88.21 104.49 7.09 Favored Pre-proline 0 N--CA 1.474 0.751 0 C-N-CA 123.955 0.902 . . . . 0.0 109.656 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.509 ' HA ' HD12 ' A' ' 40' ' ' LEU . 37.3 Cg_endo -63.16 -25.42 72.72 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.069 2.513 . . . . 0.0 113.027 -176.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -60.44 -43.7 96.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.591 0.757 . . . . 0.0 111.631 178.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.418 ' CD2' HD13 ' A' ' 34' ' ' ILE . 0.7 OUTLIER -70.87 -29.47 65.58 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 123.307 0.643 . . . . 0.0 110.432 -178.384 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 37' ' ' PRO . 32.9 mt -72.58 -37.02 68.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.437 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -62.3 -44.3 96.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.202 0.601 . . . . 0.0 110.764 172.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.513 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.0 mt-10 -60.88 -39.79 90.55 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.564 0.746 . . . . 0.0 111.657 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.63 -44.51 77.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 123.648 0.592 . . . . 0.0 111.245 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.503 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -69.14 -26.01 64.66 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.139 0.976 . . . . 0.0 111.162 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 1.9 tmmm? -77.13 -42.71 36.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.791 0.837 . . . . 0.0 109.677 177.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.27 -36.36 77.03 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.573 0.749 . . . . 0.0 110.406 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 97.7 p -87.79 -5.25 58.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.531 0.732 . . . . 0.0 111.323 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 64.68 24.02 12.87 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.545 1.138 . . . . 0.0 112.106 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.49 -2.88 30.87 Favored Glycine 0 C--N 1.347 1.143 0 CA-C-N 115.959 -0.564 . . . . 0.0 113.203 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -86.15 100.25 12.08 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.2 tt -66.62 -24.82 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.141 0.576 . . . . 0.0 112.146 -172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.8 m -67.93 -45.76 73.4 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.507 0.723 . . . . 0.0 110.191 176.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -70.22 -29.97 66.93 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.875 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.9 -51.48 61.72 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 123.442 0.697 . . . . 0.0 111.375 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.25 -38.96 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.022 177.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -54.29 -47.54 72.26 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 124.355 1.035 . . . . 0.0 110.297 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 92.0 mt -63.21 -45.28 92.38 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 123.759 0.662 . . . . 0.0 111.311 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.678 HD13 HD12 ' A' ' 34' ' ' ILE . 84.6 mt -71.06 -15.48 62.54 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.583 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 68.0 p . . . . . 0 N--CA 1.49 1.563 0 C-N-CA 122.986 0.514 . . . . 0.0 112.216 176.344 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.72 60.95 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.115 0.416 . . . . 0.0 111.436 -177.162 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.61 -42.75 88.87 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 170.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.29 -38.9 78.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.94 0.896 . . . . 0.0 110.726 -178.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.31 84.19 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.182 0.926 . . . . 0.0 111.397 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.14 -46.21 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.42 0.688 . . . . 0.0 110.195 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.48 81.09 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.656 0.782 . . . . 0.0 111.216 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.1 tp -66.46 -52.14 49.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.479 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.8 m -68.35 -26.47 65.61 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -172.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 122.651 0.38 . . . . 0.0 111.216 -179.767 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.3 tmm? . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 119.69 -0.195 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.612 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.2 pt? -56.39 -35.59 67.92 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.463 0.705 . . . . 0.0 111.886 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.612 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -61.74 -62.81 1.54 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.33 0.652 . . . . 0.0 109.632 178.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.48 -43.12 95.16 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 124.813 1.321 . . . . 0.0 111.401 -171.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.463 ' O ' HG12 ' A' ' 31' ' ' ILE . 46.6 mm-40 -66.07 -52.12 51.77 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.748 -178.187 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 40' ' ' LEU . 20.6 tp -62.5 -44.66 95.83 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -57.98 -31.33 66.8 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.666 1.186 . . . . 0.0 111.77 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -71.77 -52.2 18.84 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.313 0.645 . . . . 0.0 110.496 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 27' ' ' GLN . 15.1 pt -89.65 3.45 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 p -114.41 -51.25 2.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 167.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.53 -2.05 34.47 Favored Glycine 0 C--N 1.341 0.844 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.836 -175.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.532 HD12 HD13 ' A' ' 58' ' ' LEU . 81.7 mt -82.21 120.68 34.15 Favored 'Isoleucine or valine' 0 C--N 1.351 0.67 0 C-N-CA 123.579 0.751 . . . . 0.0 110.58 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -79.98 -26.27 40.01 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.39 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 7.4 m-20 -64.24 110.69 4.21 Favored Pre-proline 0 N--CA 1.479 1.012 0 C-N-CA 124.668 1.187 . . . . 0.0 111.225 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.21 -26.23 57.06 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.833 2.355 . . . . 0.0 112.378 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 m -58.16 -52.14 66.78 Favored 'General case' 0 C--N 1.356 0.87 0 C-N-CA 123.739 0.816 . . . . 0.0 110.113 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -57.35 -37.59 72.8 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.274 0.984 . . . . 0.0 110.991 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.599 ' HA ' HD23 ' A' ' 28' ' ' LEU . 58.7 mt -70.7 -48.48 54.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 124.172 0.92 . . . . 0.0 111.486 -174.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -68.71 -38.91 80.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.929 0.492 . . . . 0.0 111.23 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.4 mt-10 -68.1 -37.25 80.98 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.226 0.61 . . . . 0.0 111.754 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.43 -43.81 72.62 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.797 0.686 . . . . 0.0 110.685 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.523 ' HG ' ' HB2' ' A' ' 24' ' ' LEU . 3.4 mm? -62.84 -35.74 80.93 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.96 0.904 . . . . 0.0 111.03 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.2 tmmm? -68.19 -47.1 68.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.708 0.803 . . . . 0.0 110.464 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.09 -19.89 61.06 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.771 0.828 . . . . 0.0 111.74 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.6 p -96.67 -0.71 48.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.455 0.702 . . . . 0.0 111.292 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 64.51 21.9 12.56 Favored 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 124.761 1.225 . . . . 0.0 111.089 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -16.18 24.98 Favored Glycine 0 C--N 1.348 1.225 0 CA-C-N 115.978 -0.555 . . . . 0.0 113.306 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -76.97 102.35 6.38 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-N 117.328 0.564 . . . . 0.0 110.459 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.9 tt -60.24 -25.72 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.665 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 29.0 m -67.86 -47.78 67.94 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.15 0.58 . . . . 0.0 110.709 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.434 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 7.9 mm-40 -65.47 -34.73 78.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.543 0.337 . . . . 0.0 110.657 175.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.16 -42.34 90.5 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.362 0.665 . . . . 0.0 110.885 178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.24 -52.15 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 123.798 0.686 . . . . 0.0 109.723 171.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.4 m -56.76 -33.26 66.42 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.126 0.892 . . . . 0.0 112.434 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -79.7 -36.17 37.96 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.567 0.747 . . . . 0.0 111.177 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -76.0 -25.2 55.54 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 175.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.472 0.661 0 C-N-CA 123.42 0.688 . . . . 0.0 111.426 179.369 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 N--CA 1.475 0.792 0 CA-C-O 120.865 0.365 . . . . 0.0 111.409 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -22.96 61.4 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.509 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -58.84 -47.07 86.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -34.76 72.91 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.19 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.05 77.33 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.474 0.71 . . . . 0.0 111.735 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.99 -41.36 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 123.568 0.747 . . . . 0.0 110.484 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.84 -51.8 66.76 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.663 0.602 . . . . 0.0 110.489 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 34.6 tp -61.33 -40.4 94.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.324 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -59.6 -40.02 86.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.487 0.715 . . . . 0.0 111.469 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.9 tt . . . . . 0 N--CA 1.477 0.877 0 C-N-CA 123.576 0.751 . . . . 0.0 109.645 178.412 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.528 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.2 pt? -59.17 -39.49 82.66 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.648 0.779 . . . . 0.0 112.737 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -70.54 -37.63 74.08 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.328 0.251 . . . . 0.0 110.371 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.85 -45.26 90.28 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.259 0.975 . . . . 0.0 110.211 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -62.24 -51.32 68.23 Favored 'General case' 0 C--N 1.349 0.564 0 O-C-N 124.422 1.077 . . . . 0.0 110.822 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' A' ' 40' ' ' LEU . 14.7 tp -63.79 -44.21 94.01 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.891 0.745 . . . . 0.0 110.629 -176.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttt-85 -54.25 -41.81 69.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.274 1.03 . . . . 0.0 110.933 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.1 -34.69 61.76 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.449 -174.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.06 -9.08 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.3 p -102.37 -53.51 2.88 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 171.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.49 -11.44 25.94 Favored Glycine 0 N--CA 1.47 0.911 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.243 -172.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.477 HD12 HD13 ' A' ' 58' ' ' LEU . 78.9 mt -73.95 118.82 20.06 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 110.151 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -85.04 -22.5 28.98 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.963 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -62.39 111.87 5.45 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.866 0.866 . . . . 0.0 110.688 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -62.47 -32.75 80.36 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 122.894 2.396 . . . . 0.0 112.509 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.2 m -54.47 -50.8 66.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.638 0.775 . . . . 0.0 110.79 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -57.0 -37.84 72.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.233 1.013 . . . . 0.0 111.146 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.615 ' HA ' HD23 ' A' ' 28' ' ' LEU . 40.5 mt -72.63 -50.85 22.43 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.777 -1.102 . . . . 0.0 111.293 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -60.74 -44.97 96.02 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.477 0.711 . . . . 0.0 111.205 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.406 ' HA ' ' HG2' ' A' ' 45' ' ' LYS . 44.0 mt-10 -66.02 -36.5 83.42 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.014 0.926 . . . . 0.0 112.086 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.8 -41.94 70.95 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.125 0.265 . . . . 0.0 110.423 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HG ' HD12 ' A' ' 24' ' ' LEU . 2.4 mm? -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.945 0.898 . . . . 0.0 110.59 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HG2' ' HA ' ' A' ' 42' ' ' GLU . 54.6 pttt -77.29 -32.23 55.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.549 0.339 . . . . 0.0 110.506 -174.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.67 -24.98 60.05 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.013 0.525 . . . . 0.0 111.187 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.416 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 88.4 p -93.26 3.28 55.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.771 0.828 . . . . 0.0 111.217 175.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 t30 72.04 7.2 5.75 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.348 1.459 . . . . 0.0 112.041 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 21.47 4.51 Favored Glycine 0 N--CA 1.473 1.148 0 C-N-CA 123.578 0.609 . . . . 0.0 112.106 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -104.38 116.5 32.24 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.402 0.681 . . . . 0.0 109.462 -174.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 7.8 tp -65.39 -32.88 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.154 0.582 . . . . 0.0 111.888 -175.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -75.52 -41.66 54.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.697 0.799 . . . . 0.0 111.379 -175.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.416 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 16.1 mm100 -75.1 -27.65 59.94 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.351 -0.218 . . . . 0.0 110.59 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.29 71.0 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.227 0.611 . . . . 0.0 111.256 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.84 -34.4 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.713 0.405 . . . . 0.0 109.998 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.0 t -63.5 -39.2 93.82 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 123.806 0.691 . . . . 0.0 111.524 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.25 -31.92 66.22 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.689 . . . . 0.0 111.518 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.477 HD13 HD12 ' A' ' 34' ' ' ILE . 57.7 mt -81.84 -26.8 33.96 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p . . . . . 0 N--CA 1.482 1.134 0 CA-C-N 117.987 0.358 . . . . 0.0 110.968 175.626 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -34.28 76.99 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.164 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -62.42 -39.38 93.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.596 0.758 . . . . 0.0 110.577 175.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.66 -42.46 67.5 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.253 0.971 . . . . 0.0 110.747 -175.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.43 -45.57 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.988 0.805 . . . . 0.0 111.295 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.8 mm -65.42 -46.24 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.321 0.649 . . . . 0.0 110.467 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.8 78.34 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.539 0.735 . . . . 0.0 111.224 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.98 -47.41 74.63 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -69.26 -24.46 63.98 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -177.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 123.187 0.595 . . . . 0.0 111.429 -179.395 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 51.7 ttm . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.0 pt? -57.05 -34.98 68.8 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.738 0.815 . . . . 0.0 112.08 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -64.76 -51.88 59.97 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.859 0.464 . . . . 0.0 110.069 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -62.47 -49.86 73.74 Favored 'General case' 0 N--CA 1.484 1.229 0 O-C-N 124.688 1.242 . . . . 0.0 110.498 -174.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -55.24 -54.96 36.78 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.793 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' A' ' 40' ' ' LEU . 14.6 tp -70.73 -40.78 72.56 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 123.342 0.401 . . . . 0.0 111.024 -175.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -54.91 -38.05 67.13 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.179 0.992 . . . . 0.0 111.272 176.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -75.71 -42.07 51.81 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.877 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 28' ' ' LEU . 27.7 pt -86.23 -10.15 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.454 HG22 HG23 ' A' ' 55' ' ' VAL . 77.6 p -103.77 -50.84 3.31 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.428 0.632 . . . . 0.0 109.868 173.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.52 -4.61 32.9 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.541 -174.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.538 HD12 HD13 ' A' ' 58' ' ' LEU . 73.8 mt -81.0 118.8 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 124.263 1.025 . . . . 0.0 110.4 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -84.12 -18.65 36.13 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.054 -178.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 13.9 t70 -69.06 119.61 71.09 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.53 0.732 . . . . 0.0 110.27 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -69.29 -29.58 25.9 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.766 2.311 . . . . 0.0 113.287 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -63.34 -48.72 76.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.086 0.554 . . . . 0.0 110.242 -176.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -55.46 -38.62 69.31 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 124.257 0.973 . . . . 0.0 111.454 177.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.591 ' HA ' HD23 ' A' ' 28' ' ' LEU . 45.5 mt -69.57 -46.87 65.38 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.872 0.733 . . . . 0.0 110.89 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.12 -43.39 98.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.191 0.596 . . . . 0.0 111.267 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.516 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 49.2 mt-10 -70.75 -30.39 66.89 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.612 0.765 . . . . 0.0 111.833 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.58 -42.99 60.86 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 123.379 0.424 . . . . 0.0 110.347 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.463 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -66.19 -29.8 70.15 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.826 0.85 . . . . 0.0 110.21 176.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.3 tmmm? -75.21 -43.28 52.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 110.48 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.15 77.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.331 0.652 . . . . 0.0 110.738 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.9 p -88.53 -6.74 57.4 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.46 0.704 . . . . 0.0 111.405 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.4 t30 66.48 13.18 9.15 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.083 1.353 . . . . 0.0 111.825 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.01 -14.79 5.42 Favored Glycine 0 C--N 1.351 1.394 0 CA-C-O 119.744 -0.476 . . . . 0.0 113.489 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -78.27 102.49 7.67 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.197 0.499 . . . . 0.0 109.935 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.1 tt -65.04 -27.01 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.5 m -68.26 -41.94 80.34 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 121.428 0.633 . . . . 0.0 110.348 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -72.27 -33.24 67.32 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.4 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.98 -51.05 70.88 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.541 0.736 . . . . 0.0 111.386 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.454 HG23 HG22 ' A' ' 32' ' ' THR . 7.7 p -64.01 -39.81 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.195 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.2 t -60.23 -33.22 71.96 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.525 0.516 . . . . 0.0 111.905 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 99.3 mt -77.93 -36.28 49.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.001 0.52 . . . . 0.0 111.522 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.538 HD13 HD12 ' A' ' 34' ' ' ILE . 73.2 mt -78.32 -18.44 55.19 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.6 p . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 123.205 0.602 . . . . 0.0 111.008 176.875 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -30.52 69.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.225 0.61 . . . . 0.0 112.053 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -65.62 -48.24 72.92 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.028 0.531 . . . . 0.0 110.158 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.04 70.35 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.626 0.579 . . . . 0.0 111.12 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -56.16 20.05 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.085 0.554 . . . . 0.0 111.013 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -72.8 -41.92 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.324 0.65 . . . . 0.0 110.673 -175.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.35 96.15 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.944 0.498 . . . . 0.0 111.554 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.5 tp -63.6 -46.68 84.7 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -59.37 -24.73 63.65 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.17 0.588 . . . . 0.0 112.406 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 C--O 1.244 0.789 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.179 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.7 ttt . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.574 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -56.67 -38.86 72.79 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.728 0.811 . . . . 0.0 112.27 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.574 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -65.3 -46.11 81.71 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -63.23 -44.74 94.39 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 124.418 1.074 . . . . 0.0 111.271 -177.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -55.55 33.4 Favored 'General case' 0 C--N 1.349 0.55 0 O-C-N 124.532 1.145 . . . . 0.0 110.075 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 40' ' ' LEU . 13.8 tp -66.61 -44.9 80.86 Favored 'General case' 0 C--N 1.351 0.665 0 O-C-N 124.213 0.946 . . . . 0.0 111.125 -174.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -56.93 -38.8 73.39 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.419 1.088 . . . . 0.0 111.605 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -71.62 -49.62 38.46 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.753 0.658 . . . . 0.0 110.641 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.488 HD11 HD12 ' A' ' 28' ' ' LEU . 14.6 pt -74.93 -30.21 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.3 p -87.2 -48.21 8.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.892 0.477 . . . . 0.0 110.152 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.37 4.92 54.82 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.665 -174.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.64 HD12 HD13 ' A' ' 58' ' ' LEU . 72.7 mt -84.85 124.8 40.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.865 0.866 . . . . 0.0 110.463 -177.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -90.21 -12.25 38.61 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.247 1.019 . . . . 0.0 112.61 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 8.0 m-20 -72.05 109.09 5.03 Favored Pre-proline 0 N--CA 1.475 0.816 0 O-C-N 123.787 0.68 . . . . 0.0 109.688 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -63.73 -28.64 68.64 Favored 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.0 2.466 . . . . 0.0 111.413 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.3 m -58.28 -51.98 67.49 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.118 0.967 . . . . 0.0 110.537 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -60.05 -34.42 73.38 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.718 0.807 . . . . 0.0 111.263 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.682 ' HA ' HD23 ' A' ' 28' ' ' LEU . 51.9 mt -69.88 -52.38 25.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.778 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -57.04 -49.84 74.6 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.751 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.4 -38.91 91.47 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.387 0.675 . . . . 0.0 112.373 -173.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.62 -42.2 82.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.462 0.476 . . . . 0.0 110.809 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.433 HD23 HD22 ' A' ' 28' ' ' LEU . 3.7 mm? -63.76 -32.8 74.42 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.856 0.862 . . . . 0.0 111.31 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 mpmm? -75.75 -41.61 52.76 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.836 0.454 . . . . 0.0 110.461 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.29 -27.28 67.04 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.07 0.948 . . . . 0.0 111.14 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -101.83 -1.63 31.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.792 0.837 . . . . 0.0 111.705 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 m120 64.68 16.97 10.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.964 1.306 . . . . 0.0 112.283 178.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.76 -13.57 13.1 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-O 119.51 -0.605 . . . . 0.0 113.126 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.4 109.05 5.14 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 109.773 -178.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.76 -28.94 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.591 0.756 . . . . 0.0 111.601 -172.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.7 m -71.85 -45.34 61.75 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.092 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.413 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.8 mm-40 -65.45 -40.44 93.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.876 0.471 . . . . 0.0 110.158 174.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.1 75.35 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.008 0.923 . . . . 0.0 111.869 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.2 p -64.73 -39.31 85.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.661 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.533 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.8 m -62.34 -36.55 82.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.384 0.673 . . . . 0.0 112.242 178.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.4 mt -71.64 -33.81 69.24 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.448 0.699 . . . . 0.0 111.007 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.64 HD13 HD12 ' A' ' 34' ' ' ILE . 79.6 mt -84.08 -26.68 28.82 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 176.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.8 p . . . . . 0 N--CA 1.483 1.197 0 C-N-CA 123.098 0.559 . . . . 0.0 110.799 178.785 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.7 t70 . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 120.334 0.112 . . . . 0.0 111.052 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.428 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -66.47 -32.46 73.84 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.297 0.998 . . . . 0.0 111.704 -178.292 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -58.7 -57.32 13.54 Favored 'General case' 0 C--N 1.359 0.99 0 O-C-N 123.877 0.736 . . . . 0.0 110.368 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.82 -25.44 61.14 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.45 1.094 . . . . 0.0 111.386 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.81 -57.96 8.28 Favored 'General case' 0 C--N 1.354 0.779 0 C-N-CA 123.135 0.574 . . . . 0.0 110.156 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.26 -39.89 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -54.6 -59.1 5.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.021 0.928 . . . . 0.0 110.82 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 43.9 tp -67.73 -34.39 76.75 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.119 0.887 . . . . 0.0 111.398 -177.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.1 t -66.4 -30.16 70.48 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 122.381 0.272 . . . . 0.0 111.443 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 43.3 mt . . . . . 0 CA--C 1.549 0.93 0 C-N-CA 123.769 0.828 . . . . 0.0 110.96 175.436 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.0 tpt . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.507 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.5 pt? -62.54 -33.54 75.13 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.995 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.2 -49.45 71.95 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.164 0.586 . . . . 0.0 109.938 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -69.3 -42.33 75.59 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.73 -174.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -56.26 -54.34 46.49 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.364 1.065 . . . . 0.0 110.727 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.521 HD23 ' HA ' ' A' ' 40' ' ' LEU . 15.2 tp -65.08 -42.2 94.34 Favored 'General case' 0 C--N 1.357 0.922 0 O-C-N 123.496 0.498 . . . . 0.0 111.285 -177.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -57.29 -37.63 72.71 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.209 1.004 . . . . 0.0 111.4 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.45 -48.37 56.27 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.336 0.654 . . . . 0.0 111.161 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 17.7 pt -82.51 -16.18 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 74.9 p -96.05 -48.01 5.86 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.111 0.481 . . . . 0.0 109.874 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -9.87 47.33 Favored Glycine 0 N--CA 1.468 0.816 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.026 -173.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.422 HD12 ' HB3' ' A' ' 58' ' ' LEU . 88.1 mt -75.85 112.11 13.11 Favored 'Isoleucine or valine' 0 C--N 1.348 0.538 0 C-N-CA 124.202 1.001 . . . . 0.0 110.351 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -79.49 -14.92 58.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 9.4 t70 -78.17 116.33 58.03 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.07 0.948 . . . . 0.0 110.336 -175.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.01 -23.43 34.21 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.924 2.416 . . . . 0.0 113.456 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.0 m -62.31 -50.15 72.77 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.073 0.549 . . . . 0.0 110.061 -177.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.8 -38.36 78.42 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 125.112 1.507 . . . . 0.0 111.318 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 28' ' ' LEU . 43.1 mt -67.67 -46.55 72.03 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.199 0.937 . . . . 0.0 111.111 -176.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -62.27 -46.06 90.49 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.667 0.604 . . . . 0.0 111.022 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.509 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 47.2 mt-10 -65.15 -31.2 72.27 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.497 0.719 . . . . 0.0 112.16 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -43.81 64.58 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.676 0.61 . . . . 0.0 110.43 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.507 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.2 mm? -68.58 -27.05 65.72 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 0.0 110.349 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.7 tmmm? -75.38 -45.2 40.62 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.255 1.022 . . . . 0.0 110.309 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.22 -30.29 68.42 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.443 0.697 . . . . 0.0 111.274 -177.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.08 2.79 56.06 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.724 0.81 . . . . 0.0 112.123 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 67.65 11.74 8.52 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.842 1.257 . . . . 0.0 111.866 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.05 2.25 22.08 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 123.537 0.589 . . . . 0.0 113.55 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -88.17 110.26 20.55 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.352 0.596 . . . . 0.0 110.666 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.4 tt -67.99 -18.94 24.22 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.798 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 m -71.08 -50.55 32.54 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.456 0.703 . . . . 0.0 111.008 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.4 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 27.3 mm-40 -64.66 -38.64 91.69 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.903 174.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.68 62.59 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.127 0.892 . . . . 0.0 112.527 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -65.06 -41.15 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 O-C-N 123.583 0.552 . . . . 0.0 110.888 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.8 t -59.41 -42.7 92.4 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.612 0.57 . . . . 0.0 111.227 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 85.9 mt -71.18 -38.14 72.14 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.049 0.54 . . . . 0.0 111.559 -177.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.422 ' HB3' HD12 ' A' ' 34' ' ' ILE . 37.8 mt -76.78 -26.43 54.49 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.48 1.051 0 CA-C-N 118.163 0.438 . . . . 0.0 110.877 179.157 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -32.15 72.44 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.437 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -66.15 -44.85 82.94 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.94 0.496 . . . . 0.0 110.393 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.96 90.54 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.011 0.819 . . . . 0.0 110.677 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -57.76 11.33 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.206 1.003 . . . . 0.0 111.83 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.2 mm -64.47 -42.18 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.926 0.891 . . . . 0.0 111.188 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.78 88.65 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.342 0.657 . . . . 0.0 111.528 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.01 -45.65 80.77 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -67.69 -27.78 67.12 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.614 0.765 . . . . 0.0 111.908 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.9 tt . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 123.85 0.86 . . . . 0.0 109.889 -177.356 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.1 ttt . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.592 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -52.48 -39.86 61.68 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.466 0.707 . . . . 0.0 112.605 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.592 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.1 mm? -62.55 -51.99 65.18 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -60.14 -46.28 90.18 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.553 1.158 . . . . 0.0 111.809 -174.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -62.26 -55.86 24.24 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 124.138 0.899 . . . . 0.0 110.596 -178.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -62.38 -49.44 75.54 Favored 'General case' 0 C--N 1.356 0.865 0 O-C-N 123.806 0.691 . . . . 0.0 111.019 -176.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -57.27 -34.4 68.61 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.648 1.179 . . . . 0.0 111.493 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.76 -54.07 26.57 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.558 175.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.0 pt -88.5 -6.47 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -167.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 p -105.49 -40.11 5.9 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.306 0.643 . . . . 0.0 109.535 171.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.72 1.8 67.78 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.982 -176.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.573 HD12 HD13 ' A' ' 58' ' ' LEU . 67.1 mt -78.98 122.21 33.74 Favored 'Isoleucine or valine' 0 C--N 1.348 0.516 0 C-N-CA 123.939 0.896 . . . . 0.0 111.262 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -83.05 -21.0 33.92 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.985 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 10.5 m-20 -66.87 109.13 3.03 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 123.793 0.837 . . . . 0.0 110.061 -177.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -69.17 -29.54 26.51 Favored 'Trans proline' 0 C--N 1.373 1.85 0 C-N-CA 122.512 2.142 . . . . 0.0 111.763 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 m -61.4 -43.07 99.5 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.284 0.634 . . . . 0.0 109.909 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -60.73 -39.15 87.58 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 123.404 0.44 . . . . 0.0 110.36 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.613 ' HA ' HD23 ' A' ' 28' ' ' LEU . 62.0 mt -67.72 -52.85 32.82 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 124.19 0.931 . . . . 0.0 111.499 -175.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -62.36 -49.73 74.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.697 0.399 . . . . 0.0 111.54 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -65.33 -26.77 68.19 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.978 0.511 . . . . 0.0 111.878 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.23 -45.24 70.28 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.618 0.367 . . . . 0.0 110.502 171.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.468 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -66.31 -23.15 66.33 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.555 0.742 . . . . 0.0 111.091 175.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mpmm? -75.62 -45.37 37.81 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.363 0.665 . . . . 0.0 109.425 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -12.88 61.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.861 0.864 . . . . 0.0 112.048 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 98.5 p -110.44 -4.68 15.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.366 0.667 . . . . 0.0 111.725 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 65.05 20.88 12.17 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.551 1.14 . . . . 0.0 112.08 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.88 2.57 32.08 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-O 119.543 -0.587 . . . . 0.0 113.318 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -89.42 115.63 27.01 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.009 0.523 . . . . 0.0 110.305 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.556 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.6 tp -62.38 -39.13 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.468 0.307 . . . . 0.0 111.774 -173.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.1 m -66.05 -47.66 73.64 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.795 0.838 . . . . 0.0 110.89 -172.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -65.44 -36.79 84.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.239 0.615 . . . . 0.0 110.858 177.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -44.75 87.06 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 123.586 0.554 . . . . 0.0 111.336 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 51' ' ' ILE . 38.9 t -62.1 -49.3 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.866 177.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 m -54.55 -45.84 73.52 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.136 0.974 . . . . 0.0 111.762 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -71.49 -34.19 69.92 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.124 -175.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.573 HD13 HD12 ' A' ' 34' ' ' ILE . 62.8 mt -72.77 -45.52 58.19 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 175.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.1 p . . . . . 0 N--CA 1.477 0.909 0 C-N-CA 123.481 0.713 . . . . 0.0 112.012 -178.364 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.404 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -72.9 -26.87 61.57 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.757 -178.611 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -64.68 -44.59 89.86 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.496 0.318 . . . . 0.0 110.323 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.39 91.45 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.665 0.603 . . . . 0.0 111.211 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.22 75.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.761 0.824 . . . . 0.0 111.965 -177.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 43.9 mm -68.39 -38.97 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 110.764 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.27 97.27 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.962 0.505 . . . . 0.0 111.187 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.82 -45.8 87.97 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.605 176.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.7 t -66.37 -26.9 67.48 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.044 0.937 . . . . 0.0 111.798 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 123.299 0.64 . . . . 0.0 109.799 -177.055 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.4 ptt? . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.556 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -59.15 -41.71 88.97 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.2 0.6 . . . . 0.0 112.178 177.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.556 HD22 ' HG ' ' A' ' 24' ' ' LEU . 2.7 mm? -72.78 -44.91 60.98 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.104 0.161 . . . . 0.0 110.657 177.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -59.27 -51.12 71.31 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 124.071 0.857 . . . . 0.0 111.124 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -66.37 -46.98 74.85 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.11 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.489 HD22 ' CD2' ' A' ' 44' ' ' LEU . 19.0 tp -56.19 -49.99 72.5 Favored 'General case' 0 C--N 1.368 1.382 0 O-C-N 123.647 0.592 . . . . 0.0 110.428 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -54.43 -40.44 68.33 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.797 1.239 . . . . 0.0 111.546 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.89 -46.74 73.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.917 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 pt -93.38 1.59 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -170.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.513 HG21 HD12 ' A' ' 58' ' ' LEU . 68.6 p -117.83 -41.11 2.94 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.089 0.556 . . . . 0.0 110.363 171.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.85 2.47 55.12 Favored Glycine 0 N--CA 1.469 0.89 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.006 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.674 HD12 HD13 ' A' ' 58' ' ' LEU . 67.6 mt -82.15 115.55 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 110.937 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -79.65 -20.52 46.52 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.665 1.186 . . . . 0.0 111.793 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.99 108.02 3.26 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 123.517 0.727 . . . . 0.0 109.823 176.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.0 -27.2 50.45 Favored 'Trans proline' 0 C--N 1.385 2.46 0 C-N-CA 122.603 2.202 . . . . 0.0 111.137 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -58.05 -51.23 70.54 Favored 'General case' 0 C--N 1.352 0.717 0 C-N-CA 124.12 0.968 . . . . 0.0 111.19 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.51 ' CD2' HD13 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -62.49 -28.9 70.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.112 0.965 . . . . 0.0 110.664 -179.058 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.1 mt -73.2 -54.82 7.49 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.623 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -57.55 -38.09 74.17 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.397 0.679 . . . . 0.0 111.55 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -69.03 -37.04 78.38 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.535 0.734 . . . . 0.0 111.829 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.436 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -62.5 -47.77 82.49 Favored 'General case' 0 C--O 1.241 0.608 0 O-C-N 123.366 0.416 . . . . 0.0 110.868 172.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.1 mm? -64.67 -35.6 81.56 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.563 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -75.43 -36.53 60.77 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.89 -33.82 74.4 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.463 0.705 . . . . 0.0 110.616 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 m -91.1 3.14 55.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.295 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 65.55 12.05 7.91 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.141 1.377 . . . . 0.0 113.099 173.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.4 -11.56 7.16 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 119.518 -0.601 . . . . 0.0 112.624 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -79.64 108.24 13.02 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 117.401 0.601 . . . . 0.0 109.999 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.491 ' O ' HG23 ' A' ' 55' ' ' VAL . 16.2 tt -67.85 -31.34 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.969 -175.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 23.9 m -70.97 -43.39 68.18 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.039 0.536 . . . . 0.0 110.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -68.04 -32.05 72.14 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.207 175.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.96 93.78 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.386 0.675 . . . . 0.0 110.978 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.0 t -60.81 -46.4 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 123.69 0.619 . . . . 0.0 109.698 174.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.6 m -55.82 -39.18 71.02 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.567 0.747 . . . . 0.0 112.158 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.75 -40.28 63.61 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.326 0.651 . . . . 0.0 111.741 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.674 HD13 HD12 ' A' ' 34' ' ' ILE . 88.6 mt -68.69 -46.29 69.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.528 0.331 . . . . 0.0 111.878 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.6 p . . . . . 0 N--CA 1.474 0.745 0 O-C-N 124.096 0.873 . . . . 0.0 111.198 -178.449 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 N--CA 1.488 1.464 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.401 HD13 ' H ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -68.54 -33.18 73.65 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.231 0.332 . . . . 0.0 110.337 179.097 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.401 ' H ' HD13 ' A' ' 102' ' ' LEU . 15.2 mm100 -72.16 -29.54 64.13 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.642 0.777 . . . . 0.0 111.284 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.15 -44.83 59.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.799 0.84 . . . . 0.0 109.474 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.89 73.19 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.609 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.8 mm -71.04 -40.35 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.457 0.703 . . . . 0.0 111.193 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.01 96.35 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.387 0.429 . . . . 0.0 110.617 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.36 -50.48 67.54 Favored 'General case' 0 C--N 1.353 0.745 0 O-C-N 123.815 0.697 . . . . 0.0 109.71 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -63.8 -29.85 71.0 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.556 0.742 . . . . 0.0 111.211 -178.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.9 tp . . . . . 0 N--CA 1.481 1.123 0 C-N-CA 123.934 0.894 . . . . 0.0 110.561 177.739 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.453 ' H ' HD23 ' A' ' 24' ' ' LEU . 1.8 pt? -51.83 -44.95 63.78 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.685 0.794 . . . . 0.0 111.85 175.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.43 -38.63 81.37 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.019 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.37 -53.72 44.25 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 123.634 0.584 . . . . 0.0 110.376 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -50.04 -56.46 10.67 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 124.516 1.135 . . . . 0.0 109.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.4 tp -57.7 -50.16 74.12 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 124.799 1.312 . . . . 0.0 111.166 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -57.26 -39.24 75.2 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.655 1.182 . . . . 0.0 112.489 -175.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.43 -37.02 52.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.303 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 pt -90.11 -14.11 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 80.2 p -102.96 -31.18 10.36 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.288 0.635 . . . . 0.0 110.409 173.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.11 -7.43 76.17 Favored Glycine 0 N--CA 1.47 0.917 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.963 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.514 HD12 HD13 ' A' ' 58' ' ' LEU . 84.6 mt -80.04 117.35 25.72 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 C-N-CA 124.004 0.921 . . . . 0.0 110.993 -173.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -82.35 -25.82 33.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.749 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 6.7 m-20 -58.92 109.35 1.81 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 124.081 0.952 . . . . 0.0 111.13 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.84 -23.13 48.22 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.113 2.542 . . . . 0.0 111.977 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.2 m -56.91 -52.13 66.39 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.971 0.908 . . . . 0.0 109.933 174.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.35 -38.51 91.45 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.784 0.834 . . . . 0.0 110.897 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.594 ' HA ' HD23 ' A' ' 28' ' ' LEU . 73.8 mt -69.63 -55.49 9.9 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.261 0.976 . . . . 0.0 111.437 -173.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -63.96 -42.41 97.29 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.252 0.621 . . . . 0.0 111.769 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 45.2 mt-10 -72.52 -29.41 63.57 Favored 'General case' 0 C--N 1.351 0.647 0 C-N-CA 122.876 0.47 . . . . 0.0 111.881 -176.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.15 74.7 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 117.838 0.29 . . . . 0.0 110.407 172.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.463 ' CD2' HD22 ' A' ' 28' ' ' LEU . 3.0 mm? -67.79 -32.72 73.48 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.794 0.838 . . . . 0.0 110.891 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.2 tmmm? -71.53 -44.9 63.77 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.921 0.888 . . . . 0.0 110.238 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.57 -30.47 67.18 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.729 0.812 . . . . 0.0 111.447 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.3 p -85.68 0.48 52.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.448 0.699 . . . . 0.0 112.135 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 64.5 25.75 13.3 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 122.08 0.943 . . . . 0.0 110.491 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.1 65.12 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.456 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -74.58 108.51 7.38 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.552 ' O ' HG23 ' A' ' 55' ' ' VAL . 7.0 tp -55.73 -44.68 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.478 0.486 . . . . 0.0 111.784 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.5 m -66.28 -39.37 89.35 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.842 0.857 . . . . 0.0 111.329 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.492 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 mm-40 -62.9 -43.32 99.12 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 122.976 0.51 . . . . 0.0 110.029 173.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.57 -41.08 93.88 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 124.082 0.864 . . . . 0.0 111.614 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -58.86 -49.86 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.299 173.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.1 t -61.75 -31.29 71.46 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.077 0.861 . . . . 0.0 111.788 -178.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.8 mt -73.24 -33.93 65.59 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.514 HD13 HD12 ' A' ' 34' ' ' ILE . 80.2 mt -89.3 -17.54 28.75 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.4 p . . . . . 0 N--CA 1.482 1.165 0 CA-C-N 118.046 0.384 . . . . 0.0 111.867 -178.09 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.836 0.351 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.435 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -59.9 -30.8 69.27 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.181 176.836 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -67.85 -45.17 75.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.135 0.974 . . . . 0.0 110.852 -176.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.45 -27.02 61.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.564 0.746 . . . . 0.0 110.903 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.03 81.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.434 0.694 . . . . 0.0 111.233 174.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' ' 102' ' ' LEU . 42.5 mm -64.53 -42.06 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.953 0.901 . . . . 0.0 109.793 175.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.74 91.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.935 0.894 . . . . 0.0 111.383 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.08 -44.56 84.11 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.7 0.8 . . . . 0.0 109.378 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t -66.49 -36.44 82.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.516 0.726 . . . . 0.0 112.193 -175.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 48.9 mt . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -171.978 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.37 0.129 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.614 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -61.54 -40.93 96.44 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.345 1.058 . . . . 0.0 112.134 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.614 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -64.5 -51.38 63.25 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.929 0.892 . . . . 0.0 110.799 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -69.34 -44.09 72.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.294 1.038 . . . . 0.0 111.456 -172.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -64.64 -46.79 81.03 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.755 0.66 . . . . 0.0 110.949 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -61.39 -46.04 91.85 Favored 'General case' 0 C--N 1.363 1.188 0 O-C-N 123.552 0.533 . . . . 0.0 110.532 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -58.34 -36.95 74.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.782 0.833 . . . . 0.0 111.634 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.86 -45.54 64.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.015 0.526 . . . . 0.0 111.052 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.3 pt -83.22 -19.84 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.499 HG21 HD12 ' A' ' 58' ' ' LEU . 81.4 p -98.91 -40.73 7.94 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.267 0.627 . . . . 0.0 110.142 176.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.49 -3.23 57.74 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.131 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.713 HD12 HD13 ' A' ' 58' ' ' LEU . 61.6 mt -77.74 113.99 17.66 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 C-N-CA 123.588 0.755 . . . . 0.0 111.012 -172.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -81.26 -15.72 54.73 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.706 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.25 114.13 37.43 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.91 -15.86 29.45 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.776 2.317 . . . . 0.0 113.221 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -67.17 -51.02 58.81 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -55.63 -34.74 65.18 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 124.031 0.832 . . . . 0.0 111.881 176.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.2 mt -68.35 -53.81 21.53 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 123.911 0.757 . . . . 0.0 110.428 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -58.8 -38.26 78.19 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.757 175.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -74.97 -29.29 60.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.027 0.531 . . . . 0.0 111.806 -176.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.3 77.43 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -76.42 -23.32 53.98 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.929 0.892 . . . . 0.0 110.073 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -70.45 -56.36 6.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.899 1.28 . . . . 0.0 110.44 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.71 69.36 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.974 0.91 . . . . 0.0 111.061 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.506 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 89.4 p -84.43 -5.75 59.31 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.516 0.726 . . . . 0.0 112.052 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 70.1 13.32 7.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.1 1.36 . . . . 0.0 112.025 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.08 42.84 1.59 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -132.4 115.52 15.68 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.501 0.72 . . . . 0.0 109.352 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.3 tt -74.13 -21.1 17.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.327 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 83.7 m -73.06 -49.81 26.51 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.221 0.608 . . . . 0.0 110.435 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 29.0 mm-40 -60.19 -40.38 89.82 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.785 172.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.82 -52.99 63.38 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.238 0.961 . . . . 0.0 112.263 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.452 HG23 HG22 ' A' ' 32' ' ' THR . 10.1 p -64.48 -36.0 76.04 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 C-N-CA 122.6 0.36 . . . . 0.0 110.446 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.7 t -63.03 -40.97 99.32 Favored 'General case' 0 CA--C 1.554 1.135 0 O-C-N 123.751 0.657 . . . . 0.0 111.27 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.56 -22.58 54.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.668 0.787 . . . . 0.0 111.648 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 HD12 ' A' ' 34' ' ' ILE . 82.5 mt -85.66 -29.21 24.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.529 0.331 . . . . 0.0 111.545 173.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.0 p . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 122.5 0.32 . . . . 0.0 111.019 174.504 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.4 t70 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.748 0.309 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -23.58 61.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.503 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -63.19 -49.24 75.03 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 172.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.75 -38.09 85.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.652 0.595 . . . . 0.0 111.414 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.64 -49.37 68.91 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.79 0.836 . . . . 0.0 111.436 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.4 mm -67.48 -43.41 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.309 0.643 . . . . 0.0 110.467 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.37 76.9 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 123.949 0.781 . . . . 0.0 111.143 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.38 -43.47 90.62 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.033 0.933 . . . . 0.0 109.604 -178.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.8 t -76.68 -14.08 59.99 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.115 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 tt . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 172.804 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.8 tpp . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.664 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.8 pt? -59.3 -36.88 76.4 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.772 0.829 . . . . 0.0 112.718 -177.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.664 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -66.55 -46.93 74.47 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.123 0.569 . . . . 0.0 110.333 177.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -65.75 -42.55 90.78 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.251 0.97 . . . . 0.0 110.882 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -64.51 -52.58 57.07 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 124.328 1.018 . . . . 0.0 111.001 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 40' ' ' LEU . 22.2 tp -57.41 -46.97 82.92 Favored 'General case' 0 C--N 1.364 1.227 0 O-C-N 124.065 0.853 . . . . 0.0 110.264 178.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -53.96 -39.72 66.21 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.573 1.149 . . . . 0.0 111.769 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -72.55 -40.43 66.68 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.635 -176.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.0 pt -98.88 2.17 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 123.672 0.789 . . . . 0.0 112.584 -172.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.1 p -112.57 -42.49 3.64 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.307 0.643 . . . . 0.0 109.454 168.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.57 -13.87 38.97 Favored Glycine 0 N--CA 1.468 0.781 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.613 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.519 HD12 HD13 ' A' ' 58' ' ' LEU . 72.0 mt -75.16 110.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.35 0.602 0 C-N-CA 123.912 0.885 . . . . 0.0 110.332 -175.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -71.44 -32.73 68.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.057 0.943 . . . . 0.0 111.17 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -64.11 115.53 20.15 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 123.653 0.781 . . . . 0.0 111.53 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.474 ' HA ' HD12 ' A' ' 40' ' ' LEU . 42.2 Cg_endo -62.59 -22.62 74.19 Favored 'Trans proline' 0 C--N 1.391 2.812 0 C-N-CA 123.579 2.853 . . . . 0.0 112.97 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -54.43 -53.68 50.96 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.884 0.874 . . . . 0.0 110.976 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.89 -33.53 75.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.677 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.609 ' HA ' HD23 ' A' ' 28' ' ' LEU . 46.2 mt -72.28 -47.1 52.67 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 124.428 1.08 . . . . 0.0 111.038 -171.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -60.94 -54.42 45.28 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.709 0.63 . . . . 0.0 109.901 172.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.83 -30.15 68.75 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.876 0.735 . . . . 0.0 112.391 -174.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.34 -49.83 45.29 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 122.971 0.509 . . . . 0.0 110.317 174.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.505 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.4 mm? -59.04 -29.74 67.51 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.996 0.918 . . . . 0.0 111.246 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -71.65 -51.0 25.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.401 0.68 . . . . 0.0 109.794 174.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.73 62.59 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.713 0.805 . . . . 0.0 112.434 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -104.4 4.27 33.18 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.551 0.74 . . . . 0.0 112.374 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.6 t30 70.66 -2.63 2.18 Favored 'General case' 0 CA--C 1.571 1.751 0 C-N-CA 124.579 1.152 . . . . 0.0 111.582 -176.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.18 -6.95 10.79 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.777 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -79.28 105.95 10.97 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.006 0.523 . . . . 0.0 110.201 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.473 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.2 tt -65.24 -27.21 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 C-N-CA 122.914 0.485 . . . . 0.0 112.167 -173.473 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 36.3 m -66.01 -47.39 74.63 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 123.496 0.719 . . . . 0.0 110.685 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.425 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 21.1 mm-40 -60.9 -39.26 88.67 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.604 174.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.34 -41.54 89.42 Favored 'General case' 0 C--O 1.246 0.869 0 O-C-N 124.051 0.845 . . . . 0.0 111.856 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.3 t -59.18 -50.09 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 123.723 0.64 . . . . 0.0 109.71 173.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m -56.7 -41.74 77.91 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 124.307 1.004 . . . . 0.0 111.482 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -74.1 -29.85 62.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.684 0.794 . . . . 0.0 111.898 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.519 HD13 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -84.17 -32.53 24.55 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 177.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.7 p . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -173.833 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -22.91 53.6 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -61.1 -55.98 26.2 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 170.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.14 79.75 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.635 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.57 -56.17 8.08 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.398 0.679 . . . . 0.0 111.414 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.7 mm -64.22 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.226 0.61 . . . . 0.0 110.369 -178.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.25 -47.18 80.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.307 0.643 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.9 tp -65.82 -31.57 72.6 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 122.702 0.401 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.3 t -71.62 -33.61 69.11 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.548 0.739 . . . . 0.0 110.864 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 41.6 tp . . . . . 0 N--CA 1.477 0.901 0 C-N-CA 123.903 0.881 . . . . 0.0 111.022 -178.598 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.486 1.364 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.443 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.3 pt? -64.55 -39.57 94.0 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.481 0.713 . . . . 0.0 111.578 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.95 -48.16 69.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.688 0.795 . . . . 0.0 110.161 175.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -62.09 -49.9 74.08 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.618 1.199 . . . . 0.0 110.978 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.421 ' O ' HG12 ' A' ' 31' ' ' ILE . 50.2 mm-40 -62.45 -56.33 19.2 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.462 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.513 HD22 HD23 ' A' ' 44' ' ' LEU . 20.5 tp -57.56 -45.26 85.37 Favored 'General case' 0 C--N 1.36 1.061 0 O-C-N 123.784 0.677 . . . . 0.0 110.685 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -55.6 -45.28 77.47 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.77 0.828 . . . . 0.0 111.243 176.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.25 -34.96 79.18 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.296 0.638 . . . . 0.0 111.29 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.8 pt -104.8 2.42 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -173.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.1 p -112.33 -50.48 2.9 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.511 0.672 . . . . 0.0 109.668 167.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.49 22.53 10.31 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.927 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.441 HD12 HD13 ' A' ' 58' ' ' LEU . 62.4 mt -101.59 122.76 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.242 0.617 . . . . 0.0 110.28 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -81.59 -26.45 34.91 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.174 0.99 . . . . 0.0 111.91 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.13 112.54 10.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.082 0.553 . . . . 0.0 110.525 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.89 -22.01 49.49 Favored 'Trans proline' 0 C--N 1.385 2.456 0 C-N-CA 122.906 2.404 . . . . 0.0 111.872 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -57.28 -52.25 66.1 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.233 0.958 . . . . 0.0 110.188 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -60.72 -40.84 93.79 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.193 0.933 . . . . 0.0 111.584 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.511 ' HA ' HD23 ' A' ' 28' ' ' LEU . 66.0 mt -68.15 -46.28 71.23 Favored 'General case' 0 C--O 1.246 0.887 0 O-C-N 124.083 0.864 . . . . 0.0 111.488 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -64.96 -51.16 63.31 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.328 176.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -58.0 -33.08 68.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.285 0.634 . . . . 0.0 112.18 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.11 -48.88 61.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 123.747 0.654 . . . . 0.0 110.419 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.513 HD23 HD22 ' A' ' 28' ' ' LEU . 3.3 mm? -61.1 -29.64 69.88 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.903 0.881 . . . . 0.0 111.385 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -76.27 -48.19 21.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.793 0.837 . . . . 0.0 110.704 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.89 -35.3 80.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.784 0.834 . . . . 0.0 111.094 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.0 m -87.77 1.92 52.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.649 0.78 . . . . 0.0 111.571 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 66.44 12.16 8.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.848 1.259 . . . . 0.0 112.6 174.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.57 -11.87 11.15 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-O 119.805 -0.442 . . . . 0.0 112.865 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -77.97 104.88 8.81 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 121.293 0.568 . . . . 0.0 110.483 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.503 ' O ' HG23 ' A' ' 55' ' ' VAL . 18.0 tt -64.04 -26.17 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.014 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.3 m -65.13 -52.77 53.26 Favored 'General case' 0 C--O 1.251 1.179 0 C-N-CA 123.685 0.794 . . . . 0.0 110.908 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.477 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 14.3 mm100 -62.15 -37.93 87.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.815 174.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.72 -44.36 81.53 Favored 'General case' 0 C--O 1.247 0.948 0 O-C-N 124.114 0.884 . . . . 0.0 111.848 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 51' ' ' ILE . 59.6 t -59.31 -50.36 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 122.918 0.487 . . . . 0.0 109.806 172.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m -56.99 -35.75 69.56 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.333 1.021 . . . . 0.0 112.169 -175.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 76.7 mt -72.89 -44.02 61.78 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.939 0.495 . . . . 0.0 110.395 178.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.441 HD13 HD12 ' A' ' 34' ' ' ILE . 58.6 mt -78.03 -10.15 59.47 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.4 p . . . . . 0 N--CA 1.473 0.711 0 C-N-CA 122.86 0.464 . . . . 0.0 110.825 175.993 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.39 -32.35 68.35 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.463 0.705 . . . . 0.0 110.381 -178.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -66.71 -44.64 81.11 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.97 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.22 -35.17 79.03 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 124.104 0.878 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.39 8.37 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.675 0.79 . . . . 0.0 111.073 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.0 mm -61.6 -46.06 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.112 0.965 . . . . 0.0 110.966 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.32 82.31 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.131 0.895 . . . . 0.0 111.149 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -49.44 77.79 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.746 0.654 . . . . 0.0 109.432 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 45.2 m -59.38 -38.24 79.98 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.964 0.79 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.0 mt . . . . . 0 CA--C 1.547 0.856 0 C-N-CA 123.531 0.733 . . . . 0.0 111.812 -179.255 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.5 ttm . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.494 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -51.57 -41.28 61.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.035 0.934 . . . . 0.0 112.605 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.494 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.5 mm? -62.99 -52.36 63.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.679 0.792 . . . . 0.0 109.961 176.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -67.37 -39.97 85.72 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 124.218 0.949 . . . . 0.0 111.723 -172.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.442 ' O ' HG12 ' A' ' 31' ' ' ILE . 18.7 mm100 -65.52 -50.42 65.32 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.488 0.715 . . . . 0.0 110.218 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.586 HD23 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -61.55 -45.09 95.65 Favored 'General case' 0 C--N 1.357 0.919 0 O-C-N 123.878 0.737 . . . . 0.0 110.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -56.77 -37.78 71.55 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.595 1.158 . . . . 0.0 111.746 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.59 -51.08 64.59 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.893 0.877 . . . . 0.0 110.496 177.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 27' ' ' GLN . 5.8 pt -96.48 2.38 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -169.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.462 HG21 HD12 ' A' ' 58' ' ' LEU . 73.1 p -110.55 -37.97 5.32 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 167.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.4 -9.07 58.99 Favored Glycine 0 C--N 1.342 0.913 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.012 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.597 HD12 HD13 ' A' ' 58' ' ' LEU . 64.9 mt -79.58 112.17 17.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.491 0 C-N-CA 123.641 0.776 . . . . 0.0 110.409 -174.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -73.11 -29.21 62.75 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.717 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 20.0 t70 -63.09 115.33 16.76 Favored Pre-proline 0 C--N 1.35 0.611 0 C-N-CA 124.0 0.92 . . . . 0.0 111.094 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.443 ' HA ' HD12 ' A' ' 40' ' ' LEU . 58.2 Cg_endo -67.89 -25.92 38.48 Favored 'Trans proline' 0 C--N 1.381 2.287 0 C-N-CA 122.85 2.367 . . . . 0.0 112.744 -176.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.9 m -63.34 -46.6 85.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.677 0.791 . . . . 0.0 111.38 -175.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -61.07 -34.56 75.09 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.576 0.75 . . . . 0.0 111.511 174.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.586 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.6 mt -70.96 -42.06 70.27 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.856 0.723 . . . . 0.0 110.874 -177.256 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.416 ' CE1' HD11 ' A' ' 25' ' ' LEU . 49.4 m80 -66.68 -48.08 70.43 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.934 178.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.03 -27.33 65.57 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.233 0.333 . . . . 0.0 111.497 -177.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.09 -37.37 69.58 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.629 0.371 . . . . 0.0 110.441 172.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 HD22 ' A' ' 28' ' ' LEU . 1.8 mm? -73.13 -23.96 60.54 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.727 0.811 . . . . 0.0 109.501 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -74.37 -51.68 14.36 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.804 1.241 . . . . 0.0 110.3 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.13 -16.52 63.67 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.817 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 92.6 p -101.2 -7.19 23.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.303 0.641 . . . . 0.0 111.76 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 64.54 22.62 12.71 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.532 1.133 . . . . 0.0 111.583 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.76 -7.54 31.64 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.933 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.52 112.21 14.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.018 0.527 . . . . 0.0 109.718 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.576 ' O ' HG23 ' A' ' 55' ' ' VAL . 9.3 tp -59.72 -42.08 87.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.997 -175.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.8 m -64.02 -46.43 84.52 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 124.07 0.948 . . . . 0.0 111.206 -173.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -63.14 -42.98 99.58 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.767 176.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.35 -42.62 82.37 Favored 'General case' 0 C--O 1.247 0.949 0 O-C-N 123.906 0.754 . . . . 0.0 111.512 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 51' ' ' ILE . 47.0 t -60.17 -49.35 84.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.308 0.643 . . . . 0.0 109.773 175.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.4 t -62.59 -35.47 79.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.857 0.723 . . . . 0.0 112.025 -177.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.59 -27.0 55.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.565 0.746 . . . . 0.0 111.539 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.597 HD13 HD12 ' A' ' 34' ' ' ILE . 72.1 mt -86.85 -38.94 16.32 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 173.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 77.5 p . . . . . 0 N--CA 1.487 1.408 0 C-N-CA 123.292 0.637 . . . . 0.0 110.896 178.582 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 C--O 1.247 0.925 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.439 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -76.36 -33.07 58.94 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 119.156 -0.45 . . . . 0.0 112.045 -173.446 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -59.73 -41.51 91.09 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.198 0.454 . . . . 0.0 109.91 174.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.99 -46.33 78.4 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.291 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.49 96.39 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.312 1.008 . . . . 0.0 112.345 -177.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 102' ' ' LEU . 49.0 mm -72.48 -45.27 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.443 0.697 . . . . 0.0 110.688 -176.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -28.13 65.71 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.949 0.5 . . . . 0.0 111.289 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 33.2 tp -71.01 -46.09 62.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.212 0.605 . . . . 0.0 109.39 175.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -58.38 -36.03 72.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.768 0.667 . . . . 0.0 110.813 175.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 110.115 179.114 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -57.42 -35.44 70.08 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.174 0.989 . . . . 0.0 112.718 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.635 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.9 mm? -68.83 -46.48 68.46 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -69.55 -39.01 77.7 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.292 0.995 . . . . 0.0 110.529 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -62.26 -53.21 58.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.304 1.042 . . . . 0.0 110.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -58.15 -47.92 81.86 Favored 'General case' 0 C--N 1.36 1.043 0 O-C-N 123.862 0.726 . . . . 0.0 110.349 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -53.02 -42.23 65.48 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.764 1.225 . . . . 0.0 111.404 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.66 -46.47 79.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.041 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.5 pt -96.02 2.33 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 113.512 0.931 . . . . 0.0 113.512 -171.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.515 HG21 HD12 ' A' ' 58' ' ' LEU . 69.1 p -110.0 -41.78 4.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.049 0.54 . . . . 0.0 109.831 169.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.61 7.18 59.2 Favored Glycine 0 C--N 1.343 0.949 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.678 -176.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.572 HD12 HD13 ' A' ' 58' ' ' LEU . 79.0 mt -95.74 110.08 23.72 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 C-N-CA 124.053 0.941 . . . . 0.0 109.306 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -77.5 -17.74 57.7 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.9 0.88 . . . . 0.0 111.107 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 3.0 m-20 -65.19 108.08 1.84 Allowed Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 124.997 1.319 . . . . 0.0 110.011 -177.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.28 -26.75 35.28 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 123.114 2.543 . . . . 0.0 112.384 -171.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.7 t -62.39 -47.83 82.43 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.025 0.53 . . . . 0.0 109.858 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -57.89 -36.15 72.01 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.07 0.856 . . . . 0.0 111.492 176.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.528 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 mt -71.22 -51.12 26.47 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 123.972 0.795 . . . . 0.0 111.216 -174.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -60.62 -42.35 96.68 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.237 0.615 . . . . 0.0 111.585 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.487 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 40.4 mt-10 -65.99 -35.59 80.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.119 0.568 . . . . 0.0 112.144 -179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -44.77 66.43 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 123.536 0.523 . . . . 0.0 110.572 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.7 mm? -61.67 -35.55 78.29 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 124.187 0.929 . . . . 0.0 110.172 176.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.487 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.7 tmmm? -68.38 -45.29 73.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.843 0.857 . . . . 0.0 110.174 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.95 -17.97 63.34 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.789 0.836 . . . . 0.0 112.018 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 77.4 p -103.72 0.76 30.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.735 0.814 . . . . 0.0 111.507 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.0 m120 65.0 14.69 9.52 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.963 1.305 . . . . 0.0 112.435 -178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.59 12.46 Favored Glycine 0 C--N 1.353 1.472 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.873 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -79.14 99.26 6.89 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 117.571 0.685 . . . . 0.0 109.521 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 55' ' ' VAL . 17.5 tt -61.05 -29.29 45.4 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.306 0.642 . . . . 0.0 112.518 -172.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 26.8 m -64.78 -47.73 77.06 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.896 0.478 . . . . 0.0 110.608 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -63.37 -35.67 81.16 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.562 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.78 89.22 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.118 0.886 . . . . 0.0 111.274 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 51' ' ' ILE . 41.1 t -59.0 -51.84 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.466 174.545 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.7 t -57.71 -39.66 77.75 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.949 1.405 . . . . 0.0 111.195 -175.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.72 -29.94 61.35 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.139 0.576 . . . . 0.0 111.808 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.572 HD13 HD12 ' A' ' 34' ' ' ILE . 72.5 mt -76.26 -38.08 56.73 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 123.239 0.337 . . . . 0.0 111.821 173.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.239 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.238 0.466 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.418 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -70.16 -20.89 63.12 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.028 0.531 . . . . 0.0 111.579 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -54.79 42.47 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 171.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -28.93 65.46 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.407 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.415 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . . . -69.15 -50.9 43.6 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.453 0.701 . . . . 0.0 111.381 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.18 -41.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.422 0.689 . . . . 0.0 109.943 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.14 74.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.269 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.6 tp -68.54 -41.01 80.47 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.482 0.713 . . . . 0.0 111.542 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -65.56 -41.44 92.95 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.975 0.51 . . . . 0.0 111.367 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 CA--C 1.546 0.812 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.898 178.877 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.6 ptt? . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.594 ' H ' HD23 ' A' ' 24' ' ' LEU . 1.8 pt? -63.91 -36.13 82.93 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.633 1.173 . . . . 0.0 111.923 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.8 mm? -63.85 -45.66 88.53 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.246 0.618 . . . . 0.0 110.247 176.074 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -74.12 -37.23 64.15 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.064 0.853 . . . . 0.0 110.983 -172.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -59.98 -52.48 65.2 Favored 'General case' 0 C--N 1.356 0.852 0 O-C-N 124.008 0.817 . . . . 0.0 109.743 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 44' ' ' LEU . 13.2 tp -62.0 -45.22 94.58 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.338 1.024 . . . . 0.0 110.954 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -58.3 -39.31 78.99 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.994 0.918 . . . . 0.0 111.583 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.78 -50.78 61.57 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.596 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.0 pt -81.61 -19.77 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.531 HG21 HD12 ' A' ' 58' ' ' LEU . 80.6 p -99.35 -42.77 6.84 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.026 0.53 . . . . 0.0 110.556 178.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.12 -0.05 57.28 Favored Glycine 0 N--CA 1.469 0.849 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.329 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.713 HD12 HD13 ' A' ' 58' ' ' LEU . 95.4 mt -80.42 111.5 17.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.852 0.861 . . . . 0.0 109.524 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -75.04 -34.77 61.9 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.783 0.833 . . . . 0.0 110.527 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -56.51 106.65 0.71 Allowed Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 124.457 1.103 . . . . 0.0 111.241 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.543 ' HA ' HD12 ' A' ' 40' ' ' LEU . 59.8 Cg_endo -68.45 -21.16 40.9 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 122.897 2.398 . . . . 0.0 112.103 -175.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -66.69 -44.64 81.21 Favored 'General case' 0 C--N 1.349 0.579 0 C-N-CA 123.541 0.736 . . . . 0.0 110.862 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.448 ' HB3' HG21 ' A' ' 34' ' ' ILE . 2.0 t80 -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.285 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 37' ' ' PRO . 47.4 mt -72.21 -42.82 65.32 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.649 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -60.36 -43.13 96.83 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.273 0.629 . . . . 0.0 110.908 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.551 ' HA ' ' HE3' ' A' ' 45' ' ' LYS . 44.3 mt-10 -63.09 -39.03 93.51 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.623 0.769 . . . . 0.0 111.471 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.42 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -65.79 -46.72 77.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.319 0.648 . . . . 0.0 111.506 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.558 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -66.82 -30.49 70.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.038 0.935 . . . . 0.0 110.753 -179.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -75.1 -40.68 59.79 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.112 0.965 . . . . 0.0 110.108 179.018 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.57 -35.16 80.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.633 0.773 . . . . 0.0 110.365 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 m -91.12 -3.53 57.01 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.473 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 62.59 20.91 12.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.232 1.413 . . . . 0.0 112.607 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 120.93 -5.25 11.36 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 119.426 -0.652 . . . . 0.0 113.483 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -87.17 115.51 24.61 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.443 0.621 . . . . 0.0 111.012 -178.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.0 tp -66.0 -32.28 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 123.916 0.886 . . . . 0.0 111.733 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -66.44 -47.44 73.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.088 0.955 . . . . 0.0 111.786 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -69.13 -38.24 78.75 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 176.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.98 67.63 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 123.794 0.683 . . . . 0.0 111.893 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.53 -39.93 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.86 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -61.97 -31.3 71.63 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.174 0.59 . . . . 0.0 111.854 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.9 mt -83.17 -36.3 24.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.994 0.918 . . . . 0.0 111.518 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 HD12 ' A' ' 34' ' ' ILE . 53.2 mt -73.15 -29.15 62.67 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 177.195 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 N--CA 1.471 0.624 0 C-N-CA 122.766 0.427 . . . . 0.0 110.063 173.853 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.37 77.5 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.349 0.522 . . . . 0.0 110.65 176.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -61.74 -50.37 72.67 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.797 0.686 . . . . 0.0 109.98 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.19 -31.81 70.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.6 1.187 . . . . 0.0 111.651 -176.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -72.02 -46.57 56.61 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.599 0.76 . . . . 0.0 111.161 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.9 mm -67.66 -39.3 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.419 0.687 . . . . 0.0 109.596 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.39 97.03 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.09 0.956 . . . . 0.0 111.43 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.37 -40.64 85.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 0.0 109.239 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 t -65.55 -41.29 93.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.297 0.639 . . . . 0.0 111.419 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 123.256 0.622 . . . . 0.0 110.181 -177.292 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.541 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -62.08 -38.25 88.14 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.541 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.5 mm? -65.58 -46.15 80.54 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 176.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -64.45 -50.14 68.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.944 -174.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.28 71.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 112.047 -177.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.562 HD11 HD12 ' A' ' 58' ' ' LEU . 2.3 tm? -68.34 -38.07 81.15 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.2 -177.037 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -65.54 -35.65 81.48 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.178 0.591 . . . . 0.0 110.941 172.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.64 -39.12 92.86 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.58 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.2 pt -96.41 -13.97 7.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.7 p -102.43 -51.83 3.25 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.05 0.841 . . . . 0.0 110.89 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.75 7.22 42.31 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.378 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.657 HD12 HD13 ' A' ' 58' ' ' LEU . 60.6 mt -86.81 123.32 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.03 0.532 . . . . 0.0 110.891 -175.219 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -88.66 -11.63 44.74 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.98 0.912 . . . . 0.0 111.932 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.52 111.74 10.57 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-O 118.653 -0.689 . . . . 0.0 109.702 175.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.88 -36.92 81.31 Favored 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.014 2.476 . . . . 0.0 112.256 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.473 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 55.6 m -62.69 -48.9 77.3 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.577 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -52.76 -40.67 63.36 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.232 1.013 . . . . 0.0 112.127 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 28' ' ' LEU . 27.6 mt -66.26 -47.87 72.32 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 124.2 0.938 . . . . 0.0 109.788 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -61.19 -42.09 97.96 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.218 175.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 38' ' ' SER . 14.1 mm-40 -69.85 -32.98 71.66 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.356 1.063 . . . . 0.0 110.669 -174.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.87 -46.86 70.52 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 123.975 0.797 . . . . 0.0 110.672 175.115 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.431 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.6 mm? -64.31 -34.81 78.99 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.878 0.871 . . . . 0.0 109.939 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 4.1 tmmm? -69.98 -42.21 73.42 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.224 1.01 . . . . 0.0 110.244 178.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.63 -22.19 60.07 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.825 0.85 . . . . 0.0 111.358 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -104.38 5.2 34.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.287 0.635 . . . . 0.0 111.642 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 66.31 17.57 10.73 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.228 1.011 . . . . 0.0 111.529 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.49 -3.36 24.9 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.72 178.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -82.59 111.54 18.67 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.555 0.742 . . . . 0.0 110.087 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.446 HG13 HD23 ' A' ' 28' ' ' LEU . 20.6 tt -74.33 -24.6 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 122.742 0.417 . . . . 0.0 111.915 -174.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.7 m -71.66 -44.81 63.63 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.587 0.755 . . . . 0.0 110.535 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -71.45 -34.66 70.44 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.119 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -51.72 68.34 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.646 0.778 . . . . 0.0 112.242 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.43 -39.28 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 122.581 0.352 . . . . 0.0 110.741 175.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.2 t -59.82 -31.38 69.68 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.012 0.525 . . . . 0.0 111.719 178.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 88.0 mt -78.92 -41.33 29.76 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.207 0.603 . . . . 0.0 111.552 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.657 HD13 HD12 ' A' ' 34' ' ' ILE . 74.1 mt -76.22 -21.06 56.86 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.478 0.945 0 C-N-CA 122.879 0.472 . . . . 0.0 111.741 176.075 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -26.35 67.74 Favored 'General case' 0 C--N 1.349 0.565 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.225 -178.053 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -63.49 -55.53 23.3 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.43 -38.51 80.86 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.359 0.664 . . . . 0.0 111.751 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.82 -54.44 38.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.492 0.717 . . . . 0.0 111.807 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.16 -44.68 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.824 0.85 . . . . 0.0 110.583 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.53 75.34 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.716 0.806 . . . . 0.0 111.497 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.82 -39.65 83.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.927 0.891 . . . . 0.0 110.228 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -68.07 -44.95 75.17 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.736 0.415 . . . . 0.0 111.148 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt . . . . . 0 N--CA 1.475 0.82 0 C-N-CA 123.049 0.54 . . . . 0.0 111.568 179.757 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 111.421 0.156 . . . . 0.0 111.421 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.495 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.1 pt? -64.78 -35.14 80.13 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.83 0.852 . . . . 0.0 111.623 177.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.09 -53.24 58.17 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -64.67 -45.54 86.28 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.941 -173.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -61.4 -55.46 31.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.147 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.581 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.9 tp -59.76 -47.15 86.81 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 123.472 0.482 . . . . 0.0 110.45 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -53.37 -40.23 64.81 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.694 1.198 . . . . 0.0 111.857 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.76 -46.64 62.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.047 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 pt -89.9 -0.67 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.525 HG21 HD12 ' A' ' 58' ' ' LEU . 74.2 p -108.31 -46.98 3.61 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.682 0.793 . . . . 0.0 109.574 170.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.43 -8.28 40.67 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.467 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 75.0 mt -80.47 117.23 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.115 0.966 . . . . 0.0 110.486 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -83.48 -17.03 43.37 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.224 0.953 . . . . 0.0 111.22 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.72 108.8 2.41 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.116 0.966 . . . . 0.0 109.776 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.74 -30.31 59.35 Favored 'Trans proline' 0 C--N 1.379 2.136 0 C-N-CA 122.725 2.284 . . . . 0.0 112.517 -173.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.508 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 57.3 m -58.48 -52.59 64.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.018 0.527 . . . . 0.0 110.433 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -51.68 -35.08 41.2 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.303 1.041 . . . . 0.0 112.046 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.581 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.5 mt -70.96 -45.98 63.18 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 123.802 0.689 . . . . 0.0 110.643 -177.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -66.48 -37.02 84.18 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.712 0.405 . . . . 0.0 111.379 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 38' ' ' SER . 18.5 mm-40 -64.22 -46.21 84.86 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.226 1.01 . . . . 0.0 110.765 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -41.1 96.69 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.63 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.495 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.3 mm? -69.74 -37.49 76.48 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.387 0.675 . . . . 0.0 111.524 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -74.26 -36.57 63.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.433 0.293 . . . . 0.0 110.521 -176.944 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.64 -22.02 51.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.242 0.617 . . . . 0.0 111.804 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.6 p -94.96 3.13 55.3 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.234 0.614 . . . . 0.0 111.795 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 75.92 -18.7 0.45 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 125.084 1.354 . . . . 0.0 112.004 -175.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 140.05 -7.16 2.91 Favored Glycine 0 C--N 1.343 0.929 0 N-CA-C 111.971 -0.452 . . . . 0.0 111.971 -172.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -78.23 107.27 10.72 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.038 0.535 . . . . 0.0 110.558 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.463 ' O ' HG23 ' A' ' 55' ' ' VAL . 13.3 tt -66.98 -26.63 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.5 m -67.03 -50.22 62.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.397 0.618 . . . . 0.0 110.207 177.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 16.5 mm100 -61.99 -36.06 80.36 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.612 176.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.75 90.94 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 123.758 0.823 . . . . 0.0 111.7 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -59.97 -45.48 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 173.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -58.71 -35.59 72.9 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.724 0.809 . . . . 0.0 111.756 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.3 mt -71.63 -40.03 70.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.31 0.644 . . . . 0.0 111.034 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.525 HD12 HG21 ' A' ' 32' ' ' THR . 51.9 mt -75.61 -25.15 56.71 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p . . . . . 0 CA--C 1.548 0.881 0 C-N-CA 122.463 0.305 . . . . 0.0 110.441 174.678 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.3 t70 . . . . . 0 CA--C 1.549 0.928 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -29.35 70.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.979 0.512 . . . . 0.0 111.646 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -64.31 -52.71 57.18 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.091 0.556 . . . . 0.0 110.944 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.64 -30.23 68.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.323 0.649 . . . . 0.0 111.498 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.88 -54.69 30.83 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.714 0.806 . . . . 0.0 110.941 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -70.76 -36.78 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.471 0.708 . . . . 0.0 110.773 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.35 -38.91 92.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.828 0.851 . . . . 0.0 111.123 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 52.3 tp -70.94 -41.19 71.48 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.7 m -63.58 -29.58 70.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.851 0.46 . . . . 0.0 111.259 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 56.5 tp . . . . . 0 N--CA 1.472 0.627 0 C-N-CA 124.171 0.989 . . . . 0.0 109.874 179.177 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.521 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.4 pt? -66.26 -39.43 89.46 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.589 0.756 . . . . 0.0 111.12 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.521 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -66.98 -46.94 73.07 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.12 0.568 . . . . 0.0 110.188 177.088 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -62.16 -52.05 65.4 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.64 1.213 . . . . 0.0 110.968 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -58.42 -53.7 55.4 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.204 0.94 . . . . 0.0 111.043 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.442 HD12 HD22 ' A' ' 40' ' ' LEU . 2.1 tm? -56.24 -50.75 70.41 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.259 0.974 . . . . 0.0 110.027 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.436 ' HB2' HD13 ' A' ' 40' ' ' LEU . 72.4 ttt180 -61.14 -33.73 73.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.117 0.967 . . . . 0.0 111.952 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -74.12 -40.41 62.69 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.568 0.747 . . . . 0.0 110.723 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 pt -95.18 -15.5 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.589 -169.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.402 HG22 HG13 ' A' ' 55' ' ' VAL . 72.9 p -96.36 -43.13 7.8 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.95 -4.69 61.18 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.868 -177.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.495 HD12 HD13 ' A' ' 58' ' ' LEU . 62.5 mt -75.3 120.36 24.81 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 123.756 0.822 . . . . 0.0 109.443 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -86.43 -17.55 34.01 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.57 0.748 . . . . 0.0 111.353 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -70.16 109.48 4.93 Favored Pre-proline 0 N--CA 1.483 1.18 0 C-N-CA 123.544 0.738 . . . . 0.0 110.205 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.6 -25.46 79.3 Favored 'Trans proline' 0 C--N 1.388 2.637 0 C-N-CA 123.217 2.611 . . . . 0.0 113.255 -175.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m -58.36 -51.74 68.54 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.662 0.601 . . . . 0.0 110.555 177.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.15 -36.46 79.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.733 0.813 . . . . 0.0 111.423 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.442 HD22 HD12 ' A' ' 28' ' ' LEU . 13.9 mt -68.2 -56.67 7.88 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 124.386 1.054 . . . . 0.0 109.521 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 59.1 m80 -59.86 -50.19 74.75 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.117 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -56.68 -40.21 75.15 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.568 0.747 . . . . 0.0 111.903 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.8 87.3 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.739 0.65 . . . . 0.0 110.873 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.428 HD23 ' O ' ' A' ' 40' ' ' LEU . 4.3 mm? -69.35 -23.53 63.78 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.825 0.85 . . . . 0.0 111.888 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -47.94 17.87 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.31 86.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 124.228 0.955 . . . . 0.0 110.943 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.9 m -89.58 -3.29 58.37 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.778 0.831 . . . . 0.0 111.908 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 64.2 21.94 12.7 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.69 1.196 . . . . 0.0 112.47 176.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.26 -8.56 24.79 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-O 119.675 -0.514 . . . . 0.0 113.218 178.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.06 111.86 13.09 Favored 'General case' 0 C--O 1.246 0.918 0 CA-C-N 117.329 0.564 . . . . 0.0 110.519 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 55' ' ' VAL . 5.7 tp -65.98 -34.46 70.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 C-N-CA 123.268 0.627 . . . . 0.0 111.351 -173.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 35.7 m -66.65 -49.97 64.47 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.823 0.849 . . . . 0.0 110.866 -173.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -64.28 -39.94 94.96 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.259 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.88 -52.89 59.05 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.071 0.857 . . . . 0.0 112.317 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.9 t -63.73 -44.0 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 122.973 0.509 . . . . 0.0 110.433 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 t -58.5 -43.67 89.15 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 124.261 0.976 . . . . 0.0 111.187 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.16 -30.23 62.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.957 -176.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.495 HD13 HD12 ' A' ' 34' ' ' ILE . 72.8 mt -72.33 -40.71 67.21 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.481 1.088 0 C-N-CA 122.868 0.467 . . . . 0.0 111.62 -178.166 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 . . . . . 0 N--CA 1.467 0.391 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -32.1 73.42 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.225 0.61 . . . . 0.0 110.365 175.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -62.82 -56.92 13.15 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.794 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.75 -33.31 75.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 124.095 0.872 . . . . 0.0 111.421 -176.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.05 -59.62 4.24 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.427 0.691 . . . . 0.0 111.517 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.46 -41.19 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.468 0.707 . . . . 0.0 110.776 -176.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.82 -42.55 90.47 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.258 0.623 . . . . 0.0 111.799 -178.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.34 -40.91 77.27 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.6 t -62.55 -43.89 97.69 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.502 0.721 . . . . 0.0 111.332 179.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tt . . . . . 0 N--CA 1.481 1.092 0 C-N-CA 123.788 0.835 . . . . 0.0 109.786 -176.638 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -61.08 -46.44 90.62 Favored 'General case' 0 C--O 1.253 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 111.072 -178.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.522 HD22 ' HB2' ' A' ' 40' ' ' LEU . 44.3 mt -74.32 -42.58 59.23 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.817 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -62.92 -42.48 99.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.056 0.847 . . . . 0.0 111.247 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.47 ' O ' HG12 ' A' ' 31' ' ' ILE . 13.5 mm100 -63.26 -57.99 8.63 Favored 'General case' 0 C--N 1.356 0.851 0 CA-C-O 118.681 -0.676 . . . . 0.0 110.188 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' A' ' 40' ' ' LEU . 16.8 mt -51.49 -53.23 39.53 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 123.979 0.799 . . . . 0.0 111.387 176.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -53.14 -38.66 62.9 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.567 1.147 . . . . 0.0 112.162 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.49 -51.66 33.8 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.287 0.635 . . . . 0.0 110.846 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 27' ' ' GLN . 4.6 pt -91.28 4.03 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -172.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.464 HG21 HD12 ' A' ' 58' ' ' LEU . 45.3 p -122.1 -38.62 2.68 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.432 0.693 . . . . 0.0 110.344 175.283 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.94 -1.68 63.42 Favored Glycine 0 N--CA 1.475 1.287 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.488 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.44 ' HB ' HD21 ' A' ' 40' ' ' LEU . 86.0 mt -79.73 117.31 25.26 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 123.77 0.828 . . . . 0.0 109.922 -178.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -81.97 -18.6 42.9 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.739 0.649 . . . . 0.0 110.694 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 5.5 m-20 -68.77 104.88 0.81 Allowed Pre-proline 0 N--CA 1.481 1.076 0 C-N-CA 123.991 0.916 . . . . 0.0 109.747 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.71 -25.31 34.0 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.648 2.232 . . . . 0.0 111.799 -174.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.422 ' O ' ' HG3' ' A' ' 42' ' ' GLU . 42.8 m -66.61 -42.58 86.61 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.909 0.884 . . . . 0.0 110.806 177.104 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -66.08 -38.67 88.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.874 0.87 . . . . 0.0 109.821 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.522 ' HB2' HD22 ' A' ' 25' ' ' LEU . 56.5 mt -64.58 -41.42 96.27 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.604 175.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -62.5 -44.67 95.82 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 38' ' ' SER . 52.4 mt-10 -61.16 -37.87 84.44 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.587 0.555 . . . . 0.0 111.339 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.39 -48.15 62.04 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.786 0.679 . . . . 0.0 110.994 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.38 -40.62 78.55 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.397 1.079 . . . . 0.0 110.35 179.284 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.66 -37.04 59.93 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.295 1.038 . . . . 0.0 111.722 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -15.75 62.88 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.686 0.394 . . . . 0.0 111.547 178.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -106.94 11.27 30.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.853 0.861 . . . . 0.0 110.982 177.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 65.82 15.79 10.2 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.489 1.116 . . . . 0.0 112.827 175.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.15 -0.34 28.31 Favored Glycine 0 C--N 1.341 0.83 0 C-N-CA 123.36 0.505 . . . . 0.0 112.343 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -83.55 110.4 18.19 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 123.182 0.593 . . . . 0.0 111.078 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.58 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.1 tp -56.34 -38.71 56.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.707 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -58.43 -60.02 4.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.75 1.22 . . . . 0.0 112.279 -173.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.435 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 mm100 -66.93 -28.57 68.4 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.286 178.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.42 93.05 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.34 0.4 . . . . 0.0 111.019 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 51' ' ' ILE . 20.5 t -60.09 -46.99 93.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.131 0 O-C-N 123.762 0.664 . . . . 0.0 109.306 175.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.3 t -53.65 -50.41 65.82 Favored 'General case' 0 C--N 1.354 0.8 0 O-C-N 124.609 1.193 . . . . 0.0 111.683 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 89.3 mt -60.47 -44.13 96.22 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.689 0.618 . . . . 0.0 111.336 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.464 HD12 HG21 ' A' ' 32' ' ' THR . 71.6 mt -73.26 -30.88 63.74 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 176.452 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.738 0.304 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -23.23 41.01 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.693 -177.033 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -59.64 -55.83 29.45 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.64 -31.44 68.37 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.337 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.09 -56.53 21.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.861 0.464 . . . . 0.0 111.134 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.47 -43.35 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.011 0.524 . . . . 0.0 110.776 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.67 68.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.916 0.887 . . . . 0.0 111.639 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.88 -41.19 75.12 Favored 'General case' 0 C--N 1.351 0.646 0 O-C-N 123.758 0.661 . . . . 0.0 111.331 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.8 m -64.61 -31.02 72.05 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 123.369 0.418 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 C-N-CA 123.821 0.848 . . . . 0.0 109.672 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 . . . . . 0 N--CA 1.486 1.33 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 54.7 ttm -54.32 -46.14 72.77 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.292 -167.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.541 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.6 pt? -63.42 -37.26 86.59 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 40' ' ' LEU . 3.0 mm? -68.17 -44.48 75.83 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -65.84 -46.87 76.93 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.244 0.965 . . . . 0.0 111.044 -176.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.411 ' O ' HG12 ' A' ' 31' ' ' ILE . 24.7 mm-40 -59.63 -56.42 22.12 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 124.699 1.249 . . . . 0.0 110.858 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 40' ' ' LEU . 18.7 tp -56.98 -48.26 78.83 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 124.095 0.872 . . . . 0.0 110.868 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -55.1 -41.93 72.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.751 0.82 . . . . 0.0 111.434 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.55 -44.05 83.42 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.234 1.014 . . . . 0.0 109.948 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.7 pt -97.66 2.26 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -171.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.536 HG21 HD12 ' A' ' 58' ' ' LEU . 68.0 p -114.11 -49.6 2.85 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 170.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 111.69 -10.59 27.87 Favored Glycine 0 C--N 1.338 0.68 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.784 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.717 HD12 HD13 ' A' ' 58' ' ' LEU . 90.5 mt -71.32 119.86 18.41 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 C-N-CA 123.399 0.68 . . . . 0.0 110.652 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -86.37 -20.63 27.99 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.139 0.976 . . . . 0.0 111.685 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.8 t70 -70.81 114.46 26.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.194 0.598 . . . . 0.0 110.405 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.08 -30.52 65.83 Favored 'Trans proline' 0 C--N 1.382 2.299 0 C-N-CA 122.735 2.29 . . . . 0.0 113.24 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.5 t -68.66 -43.13 76.87 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.746 0.419 . . . . 0.0 110.114 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -32.09 70.92 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.524 1.129 . . . . 0.0 110.662 -179.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.5 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 mt -70.42 -48.72 54.75 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.587 178.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -55.43 -47.01 76.63 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.838 173.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.33 -28.48 67.19 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.553 0.741 . . . . 0.0 111.932 -173.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -68.98 -46.68 67.46 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 123.541 0.526 . . . . 0.0 110.831 172.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.541 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.0 mm? -61.68 -31.54 71.68 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.717 0.807 . . . . 0.0 110.632 175.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -74.52 -38.36 62.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.8 0.84 . . . . 0.0 110.758 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.15 -33.11 69.74 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.62 0.768 . . . . 0.0 111.036 -178.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.1 p -91.03 2.2 56.5 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.936 0.894 . . . . 0.0 111.474 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 66.8 t30 63.21 16.79 9.69 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.657 1.183 . . . . 0.0 111.946 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 125.92 -25.45 5.54 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.395 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -74.86 106.86 6.59 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.306 0.553 . . . . 0.0 110.536 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.457 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.8 tt -68.89 -27.9 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.055 0.542 . . . . 0.0 112.079 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -66.66 -46.33 76.05 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.469 0.707 . . . . 0.0 110.637 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.429 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.5 mm-40 -62.52 -37.28 85.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.612 173.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.66 87.87 Favored 'General case' 0 C--O 1.244 0.763 0 C-N-CA 123.523 0.729 . . . . 0.0 111.001 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.1 t -60.8 -51.24 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 123.709 0.631 . . . . 0.0 110.165 174.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -55.04 -39.32 69.02 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 124.386 1.054 . . . . 0.0 111.538 -177.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 91.8 mt -73.4 -37.07 66.07 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.399 -178.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.717 HD13 HD12 ' A' ' 34' ' ' ILE . 50.0 mt -74.11 -33.36 63.56 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 120.55 0.214 . . . . 0.0 111.484 177.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.4 p -83.77 8.12 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.096 0.558 . . . . 0.0 111.175 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.521 ' HA ' ' HB ' ' A' ' 63' ' ' VAL . 33.8 t70 -58.36 -23.53 57.16 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.399 0.68 . . . . 0.0 111.174 172.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -55.78 -21.69 20.47 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 123.865 0.866 . . . . 0.0 112.699 172.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.25 2.38 5.76 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.128 0.971 . . . . 0.0 111.757 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.521 ' HB ' ' HA ' ' A' ' 60' ' ' ASP . 73.9 t -105.87 -15.39 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 123.742 0.817 . . . . 0.0 110.416 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.53 -28.91 65.91 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 124.423 1.089 . . . . 0.0 112.917 -176.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.17 132.18 87.49 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 124.625 1.17 . . . . 0.0 111.855 -174.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.38 131.56 20.38 Favored 'Cis proline' 0 C--N 1.388 2.657 0 CA-C-N 120.24 1.122 . . . . 0.0 112.986 3.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.2 p -73.11 -172.74 1.13 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 111.708 -174.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -73.17 -175.44 1.85 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.415 0.686 . . . . 0.0 110.799 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -62.7 92.79 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.279 0.632 . . . . 0.0 111.696 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.4 p -102.23 82.72 2.23 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 168.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.24 111.84 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.068 -170.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.62 71.7 2.54 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.945 0.898 . . . . 0.0 110.53 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.5 m -144.85 115.32 7.63 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.088 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -82.52 124.39 77.81 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.193 0.997 . . . . 0.0 108.927 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.86 124.69 12.94 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.464 2.776 . . . . 0.0 113.447 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.6 m -63.02 117.84 7.01 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.69 0.796 . . . . 0.0 110.64 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -29.04 66.88 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.656 0.783 . . . . 0.0 111.36 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 46.3 t -98.32 108.42 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -112.95 97.65 6.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.595 0.758 . . . . 0.0 109.187 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.17 -26.57 73.42 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.46 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.8 p -74.04 82.68 1.75 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.187 0.995 . . . . 0.0 110.308 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.85 -34.07 26.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.362 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -73.66 97.27 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.506 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -63.45 -27.99 69.67 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.777 0.831 . . . . 0.0 110.744 175.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -71.07 113.24 7.91 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.983 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -105.02 104.77 14.56 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.57 0.748 . . . . 0.0 109.202 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.55 92.48 3.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.9 tp -87.54 92.88 9.25 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -121.64 100.74 7.18 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.418 ' N ' ' HE2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -64.65 160.24 20.24 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.08 0.552 . . . . 0.0 111.974 -177.805 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.2 34.65 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.584 0.706 . . . . 0.0 109.887 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 16.8 mt -90.79 28.52 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 C-N-CA 124.18 0.992 . . . . 0.0 110.248 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -77.44 83.89 3.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.896 0.855 . . . . 0.0 109.969 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.439 ' H ' HD23 ' A' ' 94' ' ' LEU . 1.8 pt? -84.23 57.28 4.15 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-O 122.588 1.185 . . . . 0.0 110.227 176.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.0 t -76.16 76.61 2.99 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.336 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -80.0 -34.56 38.41 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 114.286 -1.325 . . . . 0.0 109.274 -177.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.3 p30 42.77 29.09 0.15 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 126.591 1.956 . . . . 0.0 114.649 172.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -65.24 114.45 4.72 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.957 0.503 . . . . 0.0 110.555 -175.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -69.51 155.52 40.34 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 124.184 0.928 . . . . 0.0 110.587 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.27 -15.83 61.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.261 0.624 . . . . 0.0 111.54 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -62.86 -62.02 2.01 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 123.665 0.786 . . . . 0.0 111.457 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -29.04 64.94 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.07 0.395 . . . . 0.0 111.0 -177.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -64.19 -52.68 57.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.025 0.53 . . . . 0.0 110.468 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.01 -23.22 61.36 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.156 0.91 . . . . 0.0 111.4 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.38 -52.98 21.88 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.939 0.496 . . . . 0.0 111.025 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.8 mm -64.01 -43.23 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.718 0.807 . . . . 0.0 109.611 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.74 -41.71 95.91 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.03 0.932 . . . . 0.0 110.911 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 tt -66.16 -44.82 82.99 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.861 0.865 . . . . 0.0 110.213 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -64.39 -34.4 78.08 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.489 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.36 -28.0 38.11 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.203 0.601 . . . . 0.0 110.869 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.76 -34.43 69.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.976 0.51 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.69 12.34 7.37 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.4 t -52.96 119.22 15.7 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.647 0.779 . . . . 0.0 110.335 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.17 158.34 15.15 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 123.132 2.555 . . . . 0.0 114.573 -174.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.69 -4.77 39.33 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.168 175.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.478 HG23 ' H ' ' A' ' 121' ' ' ARG . 45.9 mm -64.57 109.44 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -100.14 9.41 42.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.161 0.585 . . . . 0.0 111.713 -177.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -157.6 81.99 0.89 Allowed 'General case' 0 C--N 1.351 0.633 0 C-N-CA 122.192 0.197 . . . . 0.0 110.995 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 38.6 t70 65.17 -71.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 125.336 1.454 . . . . 0.0 113.204 169.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -163.64 75.32 0.17 Allowed Glycine 0 C--N 1.347 1.158 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.478 ' H ' HG23 ' A' ' 116' ' ' ILE . 28.5 mmm180 -94.29 23.35 5.19 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.866 0.866 . . . . 0.0 111.921 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.435 ' HB3' HD22 ' A' ' 123' ' ' LEU . 19.2 t70 -60.19 -40.47 90.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.63 0.772 . . . . 0.0 110.027 173.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.435 HD22 ' HB3' ' A' ' 122' ' ' ASP . 2.7 mm? -86.24 37.13 0.71 Allowed 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.011 -177.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -64.25 128.64 36.69 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 168.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? 64.51 38.6 7.32 Favored 'General case' 0 CA--C 1.559 1.301 0 O-C-N 124.43 1.081 . . . . 0.0 111.032 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.54 164.06 27.04 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.13 173.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -121.59 102.98 8.58 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 173.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.87 -28.12 69.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.413 0.685 . . . . 0.0 112.525 -175.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 67.55 29.98 6.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.801 1.241 . . . . 0.0 112.314 175.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.4 m -75.61 91.53 2.86 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.5 p -77.72 91.07 4.03 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.927 -178.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.966 0 C-N-CA 124.379 1.072 . . . . 0.0 109.239 -179.264 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 13.4 mm100 . . . . . 0 N--CA 1.477 0.901 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.1 tpt -50.02 -43.81 50.94 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.668 0.787 . . . . 0.0 111.661 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.59 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.5 pt? -70.48 -38.16 74.35 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.659 0.784 . . . . 0.0 111.926 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.59 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.0 mm? -65.67 -53.19 44.54 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.824 0.449 . . . . 0.0 110.072 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -65.05 -41.41 95.19 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.968 1.418 . . . . 0.0 111.66 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -57.83 -51.49 69.38 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.802 0.441 . . . . 0.0 110.125 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.455 HD22 ' CD2' ' A' ' 44' ' ' LEU . 14.4 tp -63.08 -37.32 86.72 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 123.697 0.623 . . . . 0.0 110.821 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 20.2 ttp180 -63.02 -39.34 94.46 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.147 0.979 . . . . 0.0 110.62 -176.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.56 -20.18 34.27 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.422 -177.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.454 HG12 ' HA ' ' A' ' 28' ' ' LEU . 17.1 pt -99.4 -8.32 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 176.07 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.476 HG21 HD12 ' A' ' 58' ' ' LEU . 69.2 p -108.54 -48.12 3.38 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.06 0.544 . . . . 0.0 110.675 174.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.84 -16.44 28.24 Favored Glycine 0 N--CA 1.467 0.74 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.81 -175.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.678 HD12 HD13 ' A' ' 58' ' ' LEU . 57.0 mt -72.68 107.23 3.26 Favored 'Isoleucine or valine' 0 C--N 1.357 0.91 0 C-N-CA 124.039 0.935 . . . . 0.0 110.238 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -78.77 -1.69 35.95 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.025 0.93 . . . . 0.0 111.793 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -88.21 104.49 7.09 Favored Pre-proline 0 N--CA 1.474 0.751 0 C-N-CA 123.955 0.902 . . . . 0.0 109.656 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.509 ' HA ' HD12 ' A' ' 40' ' ' LEU . 37.3 Cg_endo -63.16 -25.42 72.72 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.069 2.513 . . . . 0.0 113.027 -176.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -60.44 -43.7 96.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.591 0.757 . . . . 0.0 111.631 178.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.418 ' CD2' HD13 ' A' ' 34' ' ' ILE . 0.7 OUTLIER -70.87 -29.47 65.58 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 123.307 0.643 . . . . 0.0 110.432 -178.384 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 37' ' ' PRO . 32.9 mt -72.58 -37.02 68.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.437 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -62.3 -44.3 96.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.202 0.601 . . . . 0.0 110.764 172.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.513 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.0 mt-10 -60.88 -39.79 90.55 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.564 0.746 . . . . 0.0 111.657 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.63 -44.51 77.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 123.648 0.592 . . . . 0.0 111.245 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.503 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -69.14 -26.01 64.66 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.139 0.976 . . . . 0.0 111.162 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 1.9 tmmm? -77.13 -42.71 36.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.791 0.837 . . . . 0.0 109.677 177.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.27 -36.36 77.03 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.573 0.749 . . . . 0.0 110.406 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 97.7 p -87.79 -5.25 58.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.531 0.732 . . . . 0.0 111.323 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 64.68 24.02 12.87 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.545 1.138 . . . . 0.0 112.106 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.49 -2.88 30.87 Favored Glycine 0 C--N 1.347 1.143 0 CA-C-N 115.959 -0.564 . . . . 0.0 113.203 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -86.15 100.25 12.08 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.2 tt -66.62 -24.82 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.141 0.576 . . . . 0.0 112.146 -172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.8 m -67.93 -45.76 73.4 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.507 0.723 . . . . 0.0 110.191 176.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -70.22 -29.97 66.93 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.875 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.9 -51.48 61.72 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 123.442 0.697 . . . . 0.0 111.375 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.25 -38.96 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.022 177.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -54.29 -47.54 72.26 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 124.355 1.035 . . . . 0.0 110.297 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 92.0 mt -63.21 -45.28 92.38 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 123.759 0.662 . . . . 0.0 111.311 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.678 HD13 HD12 ' A' ' 34' ' ' ILE . 84.6 mt -71.06 -15.48 62.54 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.583 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 68.0 p -116.64 1.16 12.81 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 122.986 0.514 . . . . 0.0 112.216 176.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -32.68 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.033 0.444 . . . . 0.0 109.999 174.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -70.82 -10.26 59.19 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.547 -177.827 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 59' ' ' THR . 33.1 ptt180 -95.22 -33.3 12.65 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.732 0.413 . . . . 0.0 110.364 175.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.8 p -98.76 19.13 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.888 0.875 . . . . 0.0 110.107 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.09 111.83 1.32 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.413 1.085 . . . . 0.0 111.277 174.167 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -56.43 132.62 76.64 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 122.963 0.505 . . . . 0.0 111.462 166.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.19 128.56 16.64 Favored 'Cis proline' 0 C--N 1.375 1.973 0 C-N-CA 124.579 -1.009 . . . . 0.0 113.283 -0.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 64.9 p -153.86 157.16 38.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 0.0 109.311 176.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -148.4 111.44 4.87 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.206 0.602 . . . . 0.0 109.88 177.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -160.83 158.4 28.33 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.7 t -93.06 166.69 12.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.895 0.478 . . . . 0.0 111.563 -174.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.4 t -84.77 107.48 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 123.347 0.659 . . . . 0.0 110.173 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.48 -5.84 38.59 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.446 0.698 . . . . 0.0 110.823 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.1 m -89.36 101.27 13.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.3 0.64 . . . . 0.0 109.379 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.1 121.07 80.22 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 110.619 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.92 71.38 5.59 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 123.248 2.632 . . . . 0.0 110.849 170.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.3 p -74.58 82.03 2.01 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.242 1.017 . . . . 0.0 110.396 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -101.21 83.28 2.46 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.5 m -127.85 140.47 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.595 0.758 . . . . 0.0 110.478 -173.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -89.88 147.26 23.86 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.575 0.75 . . . . 0.0 109.315 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -104.4 25.86 24.61 Favored Glycine 0 N--CA 1.476 1.329 0 O-C-N 123.368 0.418 . . . . 0.0 112.377 175.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.7 p -84.14 94.78 8.44 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.733 0.813 . . . . 0.0 110.14 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -140.27 39.7 1.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.863 0.865 . . . . 0.0 109.692 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -76.34 101.06 5.36 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.584 0.754 . . . . 0.0 110.124 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.0 p-10 -138.17 101.08 4.31 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.876 0.871 . . . . 0.0 109.036 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -79.32 78.99 5.79 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.714 0.768 . . . . 0.0 109.433 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -122.36 156.09 34.66 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.974 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.7 t -92.05 139.75 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.477 0.711 . . . . 0.0 109.194 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.21 41.88 1.03 Allowed 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.873 0.869 . . . . 0.0 109.478 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -89.29 140.4 29.53 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.396 0.679 . . . . 0.0 109.715 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.72 153.08 14.45 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.397 0.679 . . . . 0.0 109.621 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 35.7 t -127.73 69.26 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 176.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 30.5 mm -116.41 75.84 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.53 76.83 6.14 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.785 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.99 -14.91 33.0 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.01 0.924 . . . . 0.0 109.206 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.7 m -64.25 93.46 0.09 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.813 0.845 . . . . 0.0 111.328 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -90.46 127.76 36.31 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.189 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -98.82 123.77 43.27 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 48.9 m-20 -78.14 91.3 4.31 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -60.47 149.6 33.81 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.006 0.923 . . . . 0.0 111.5 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.93 -13.38 4.39 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.132 1.773 . . . . 0.0 114.717 -174.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.41 -60.91 2.66 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.929 0.891 . . . . 0.0 112.559 -178.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.72 60.95 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.115 0.416 . . . . 0.0 111.436 -177.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.61 -42.75 88.87 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 170.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.29 -38.9 78.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.94 0.896 . . . . 0.0 110.726 -178.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.31 84.19 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.182 0.926 . . . . 0.0 111.397 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.14 -46.21 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.42 0.688 . . . . 0.0 110.195 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.48 81.09 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.656 0.782 . . . . 0.0 111.216 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.1 tp -66.46 -52.14 49.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.479 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.8 m -68.35 -26.47 65.61 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -172.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -91.81 -36.22 13.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.651 0.38 . . . . 0.0 111.216 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.7 -1.79 56.56 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -73.88 -164.62 0.24 Allowed 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.482 0.658 . . . . 0.0 111.298 173.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.1 p -134.3 121.86 15.67 Favored Pre-proline 0 C--O 1.244 0.766 0 C-N-CA 123.861 0.864 . . . . 0.0 109.236 -178.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -61.7 114.56 2.32 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.353 2.035 . . . . 0.0 110.68 170.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.598 ' H ' ' HD3' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -87.63 16.31 5.78 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.068 0.547 . . . . 0.0 111.091 -179.042 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -61.94 106.43 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 123.568 0.747 . . . . 0.0 109.966 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -102.18 -40.27 6.87 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.597 0.759 . . . . 0.0 110.793 -176.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.73 6.55 15.01 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -170.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 60.6 92.92 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.532 1.133 . . . . 0.0 110.189 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 78.58 103.17 0.21 Allowed Glycine 0 C--N 1.341 0.836 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 -166.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 74.42 142.28 0.07 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 125.772 1.629 . . . . 0.0 110.914 -174.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.9 -48.17 7.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.08 0.952 . . . . 0.0 110.753 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -165.3 127.03 2.04 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -144.78 145.48 31.68 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.428 0.691 . . . . 0.0 109.302 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -142.54 24.86 1.88 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.997 0.919 . . . . 0.0 109.998 -178.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.46 ' HB3' ' HG2' ' A' ' 128' ' ' GLU . 1.9 mpt? -116.22 130.52 56.83 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.348 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -94.06 17.31 12.65 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.324 0.65 . . . . 0.0 111.495 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.46 ' HG2' ' HB3' ' A' ' 126' ' ' MET . 12.5 pt-20 -75.21 130.67 39.54 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.125 0.57 . . . . 0.0 109.628 173.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.55 153.05 21.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.636 0.775 . . . . 0.0 109.291 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 22.5 m -63.34 96.3 0.11 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.096 0.559 . . . . 0.0 110.375 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -87.04 -19.27 28.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.919 0.888 . . . . 0.0 110.494 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.138 0.975 . . . . 0.0 109.376 177.524 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 119.688 -0.196 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -55.48 -57.11 13.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.733 0.813 . . . . 0.0 111.205 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.612 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.2 pt? -56.39 -35.59 67.92 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.463 0.705 . . . . 0.0 111.886 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.612 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -61.74 -62.81 1.54 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.33 0.652 . . . . 0.0 109.632 178.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.48 -43.12 95.16 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 124.813 1.321 . . . . 0.0 111.401 -171.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.463 ' O ' HG12 ' A' ' 31' ' ' ILE . 46.6 mm-40 -66.07 -52.12 51.77 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.748 -178.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 40' ' ' LEU . 20.6 tp -62.5 -44.66 95.83 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -57.98 -31.33 66.8 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.666 1.186 . . . . 0.0 111.77 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -71.77 -52.2 18.84 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.313 0.645 . . . . 0.0 110.496 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 27' ' ' GLN . 15.1 pt -89.65 3.45 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 p -114.41 -51.25 2.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 167.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.53 -2.05 34.47 Favored Glycine 0 C--N 1.341 0.844 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.836 -175.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.532 HD12 HD13 ' A' ' 58' ' ' LEU . 81.7 mt -82.21 120.68 34.15 Favored 'Isoleucine or valine' 0 C--N 1.351 0.67 0 C-N-CA 123.579 0.751 . . . . 0.0 110.58 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -79.98 -26.27 40.01 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.39 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 7.4 m-20 -64.24 110.69 4.21 Favored Pre-proline 0 N--CA 1.479 1.012 0 C-N-CA 124.668 1.187 . . . . 0.0 111.225 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.21 -26.23 57.06 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.833 2.355 . . . . 0.0 112.378 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 m -58.16 -52.14 66.78 Favored 'General case' 0 C--N 1.356 0.87 0 C-N-CA 123.739 0.816 . . . . 0.0 110.113 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -57.35 -37.59 72.8 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.274 0.984 . . . . 0.0 110.991 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.599 ' HA ' HD23 ' A' ' 28' ' ' LEU . 58.7 mt -70.7 -48.48 54.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 124.172 0.92 . . . . 0.0 111.486 -174.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -68.71 -38.91 80.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.929 0.492 . . . . 0.0 111.23 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.4 mt-10 -68.1 -37.25 80.98 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.226 0.61 . . . . 0.0 111.754 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.43 -43.81 72.62 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.797 0.686 . . . . 0.0 110.685 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.523 ' HG ' ' HB2' ' A' ' 24' ' ' LEU . 3.4 mm? -62.84 -35.74 80.93 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.96 0.904 . . . . 0.0 111.03 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.2 tmmm? -68.19 -47.1 68.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.708 0.803 . . . . 0.0 110.464 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.09 -19.89 61.06 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.771 0.828 . . . . 0.0 111.74 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.6 p -96.67 -0.71 48.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.455 0.702 . . . . 0.0 111.292 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 64.51 21.9 12.56 Favored 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 124.761 1.225 . . . . 0.0 111.089 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -16.18 24.98 Favored Glycine 0 C--N 1.348 1.225 0 CA-C-N 115.978 -0.555 . . . . 0.0 113.306 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -76.97 102.35 6.38 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-N 117.328 0.564 . . . . 0.0 110.459 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.9 tt -60.24 -25.72 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.665 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 29.0 m -67.86 -47.78 67.94 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.15 0.58 . . . . 0.0 110.709 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.434 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 7.9 mm-40 -65.47 -34.73 78.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.543 0.337 . . . . 0.0 110.657 175.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.16 -42.34 90.5 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.362 0.665 . . . . 0.0 110.885 178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.24 -52.15 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 123.798 0.686 . . . . 0.0 109.723 171.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.4 m -56.76 -33.26 66.42 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.126 0.892 . . . . 0.0 112.434 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -79.7 -36.17 37.96 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.567 0.747 . . . . 0.0 111.177 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -76.0 -25.2 55.54 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 175.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.5 p -93.16 10.9 29.76 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.42 0.688 . . . . 0.0 111.426 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -52.21 -38.71 58.76 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.959 0.904 . . . . 0.0 111.277 175.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -59.24 -26.88 65.26 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.244 1.018 . . . . 0.0 113.396 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -104.54 -26.82 12.21 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 118.121 0.419 . . . . 0.0 111.325 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.1 p -102.38 9.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.078 0.551 . . . . 0.0 110.992 -175.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -67.37 100.15 0.8 Allowed 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 121.744 0.783 . . . . 0.0 110.103 175.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.34 151.08 83.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.484 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -78.22 158.62 93.43 Favored 'Cis proline' 0 C--N 1.383 2.361 0 CA-C-N 119.755 0.948 . . . . 0.0 113.573 4.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -152.22 124.28 8.08 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 123.88 0.872 . . . . 0.0 109.531 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -75.55 92.93 2.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.301 0.641 . . . . 0.0 109.358 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -157.05 159.76 38.27 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.878 0.871 . . . . 0.0 109.476 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.2 t -62.62 107.05 0.87 Allowed 'General case' 0 CA--C 1.554 1.11 0 CA-C-O 121.893 0.854 . . . . 0.0 110.958 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.3 m -97.33 141.51 15.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 115.065 -0.971 . . . . 0.0 109.876 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.44 78.4 4.91 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.229 0.538 . . . . 0.0 109.717 178.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.1 t -108.08 129.09 55.17 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 123.698 0.799 . . . . 0.0 109.309 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -85.63 142.59 37.33 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.81 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -58.02 151.64 56.69 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 123.462 2.775 . . . . 0.0 113.79 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.3 t -141.57 143.63 33.83 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.027 0.931 . . . . 0.0 109.093 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.84 -10.73 59.78 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.01 0.524 . . . . 0.0 111.688 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.8 t -75.33 81.45 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-O 121.648 0.737 . . . . 0.0 109.462 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -98.26 169.15 9.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.1 0.96 . . . . 0.0 110.278 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 121.64 -32.4 4.66 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.815 -178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 42.0 p -78.72 6.46 8.87 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.963 0.905 . . . . 0.0 112.358 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.05 -25.31 62.58 Favored 'General case' 0 C--N 1.355 0.816 0 C-N-CA 123.744 0.818 . . . . 0.0 110.773 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.22 84.14 1.87 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.563 0.745 . . . . 0.0 111.29 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -99.02 -63.99 1.07 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt 58.95 86.37 0.09 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.442 1.497 . . . . 0.0 111.291 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.24 48.99 0.84 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 110.041 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 22.9 m -63.2 155.53 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.262 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 mt -89.21 12.51 15.71 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.141 0.977 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -93.53 117.88 30.64 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.228 1.011 . . . . 0.0 110.563 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.45 166.37 31.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.397 1.079 . . . . 0.0 109.556 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.1 p -100.15 30.88 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 CA-C-O 122.155 0.979 . . . . 0.0 111.295 -174.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.7 mt -91.27 68.63 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -87.96 80.87 7.64 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.98 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.96 -10.41 59.46 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.357 174.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 45.1 p -59.43 -53.6 56.28 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.812 1.245 . . . . 0.0 111.37 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -106.89 89.72 3.09 Favored 'General case' 0 C--O 1.245 0.832 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 172.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -144.61 86.11 1.8 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.294 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -72.46 134.09 45.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.044 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -86.25 137.85 32.3 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.147 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -86.16 17.64 3.52 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.43 1.092 . . . . 0.0 112.053 -176.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -59.67 -66.69 0.47 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.47 1.108 . . . . 0.0 111.409 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -22.96 61.4 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.509 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.84 -47.07 86.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -34.76 72.91 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.19 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.05 77.33 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.474 0.71 . . . . 0.0 111.735 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.99 -41.36 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 123.568 0.747 . . . . 0.0 110.484 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.494 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -61.84 -51.8 66.76 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.663 0.602 . . . . 0.0 110.489 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 34.6 tp -61.33 -40.4 94.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.324 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -59.6 -40.02 86.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.487 0.715 . . . . 0.0 111.469 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.27 -39.32 92.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.576 0.751 . . . . 0.0 109.645 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 60.4 mt -77.54 -24.52 49.88 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.418 0.687 . . . . 0.0 112.097 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 108' ' ' LEU . 18.5 mm-40 -75.99 -47.16 26.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.204 0.601 . . . . 0.0 110.397 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.5 p -70.0 133.08 88.12 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.99 175.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.6 146.24 66.73 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.204 1.936 . . . . 0.0 111.165 175.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -11.44 57.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.029 0.531 . . . . 0.0 109.945 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 45.8 mm -42.82 119.71 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 125.651 1.58 . . . . 0.0 111.995 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.38 -37.58 87.44 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.074 0.55 . . . . 0.0 111.013 -176.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -174.15 163.72 3.93 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.078 0.951 . . . . 0.0 109.702 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.1 t70 63.89 -85.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.463 1.105 . . . . 0.0 111.467 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -173.49 33.1 0.11 Allowed Glycine 0 C--N 1.342 0.863 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.23 153.08 42.45 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.252 1.021 . . . . 0.0 110.675 -171.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -127.54 100.68 6.1 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.948 0.899 . . . . 0.0 108.815 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 43.1 tp 59.38 -76.08 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.78 1.632 . . . . 0.0 112.111 -174.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 25.41 -72.37 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 128.003 2.521 . . . . 0.0 116.923 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.14 78.01 8.87 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 109.905 -173.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 14.1 tpt -78.2 129.33 34.99 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 173.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -68.72 154.06 42.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.833 0.453 . . . . 0.0 109.853 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.03 127.86 33.29 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.883 0.473 . . . . 0.0 109.967 176.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -104.94 79.44 1.51 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.947 0.499 . . . . 0.0 109.707 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 34.4 m -110.5 112.09 23.78 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 m -77.14 113.63 15.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.515 0.726 . . . . 0.0 109.77 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.88 0.872 . . . . 0.0 108.9 179.11 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 N--CA 1.485 1.31 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.0 tpt -50.11 -48.69 53.34 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.382 1.073 . . . . 0.0 112.989 -172.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.528 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.2 pt? -59.17 -39.49 82.66 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.648 0.779 . . . . 0.0 112.737 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -70.54 -37.63 74.08 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.328 0.251 . . . . 0.0 110.371 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.85 -45.26 90.28 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.259 0.975 . . . . 0.0 110.211 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -62.24 -51.32 68.23 Favored 'General case' 0 C--N 1.349 0.564 0 O-C-N 124.422 1.077 . . . . 0.0 110.822 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' A' ' 40' ' ' LEU . 14.7 tp -63.79 -44.21 94.01 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.891 0.745 . . . . 0.0 110.629 -176.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttt-85 -54.25 -41.81 69.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.274 1.03 . . . . 0.0 110.933 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.1 -34.69 61.76 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.449 -174.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.06 -9.08 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.3 p -102.37 -53.51 2.88 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 171.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.49 -11.44 25.94 Favored Glycine 0 N--CA 1.47 0.911 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.243 -172.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.477 HD12 HD13 ' A' ' 58' ' ' LEU . 78.9 mt -73.95 118.82 20.06 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 110.151 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -85.04 -22.5 28.98 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.963 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -62.39 111.87 5.45 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.866 0.866 . . . . 0.0 110.688 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -62.47 -32.75 80.36 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 122.894 2.396 . . . . 0.0 112.509 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.2 m -54.47 -50.8 66.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.638 0.775 . . . . 0.0 110.79 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -57.0 -37.84 72.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.233 1.013 . . . . 0.0 111.146 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.615 ' HA ' HD23 ' A' ' 28' ' ' LEU . 40.5 mt -72.63 -50.85 22.43 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.777 -1.102 . . . . 0.0 111.293 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -60.74 -44.97 96.02 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.477 0.711 . . . . 0.0 111.205 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.406 ' HA ' ' HG2' ' A' ' 45' ' ' LYS . 44.0 mt-10 -66.02 -36.5 83.42 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.014 0.926 . . . . 0.0 112.086 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.8 -41.94 70.95 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.125 0.265 . . . . 0.0 110.423 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HG ' HD12 ' A' ' 24' ' ' LEU . 2.4 mm? -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.945 0.898 . . . . 0.0 110.59 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HG2' ' HA ' ' A' ' 42' ' ' GLU . 54.6 pttt -77.29 -32.23 55.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.549 0.339 . . . . 0.0 110.506 -174.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.67 -24.98 60.05 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.013 0.525 . . . . 0.0 111.187 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.416 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 88.4 p -93.26 3.28 55.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.771 0.828 . . . . 0.0 111.217 175.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 t30 72.04 7.2 5.75 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.348 1.459 . . . . 0.0 112.041 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 21.47 4.51 Favored Glycine 0 N--CA 1.473 1.148 0 C-N-CA 123.578 0.609 . . . . 0.0 112.106 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -104.38 116.5 32.24 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.402 0.681 . . . . 0.0 109.462 -174.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 7.8 tp -65.39 -32.88 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.154 0.582 . . . . 0.0 111.888 -175.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -75.52 -41.66 54.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.697 0.799 . . . . 0.0 111.379 -175.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.416 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 16.1 mm100 -75.1 -27.65 59.94 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.351 -0.218 . . . . 0.0 110.59 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.29 71.0 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.227 0.611 . . . . 0.0 111.256 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.84 -34.4 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.713 0.405 . . . . 0.0 109.998 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.0 t -63.5 -39.2 93.82 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 123.806 0.691 . . . . 0.0 111.524 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.25 -31.92 66.22 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.689 . . . . 0.0 111.518 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.477 HD13 HD12 ' A' ' 34' ' ' ILE . 57.7 mt -81.84 -26.8 33.96 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -92.81 -0.03 57.33 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 117.987 0.358 . . . . 0.0 110.968 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.64 -40.07 59.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.151 0.98 . . . . 0.0 111.793 174.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -56.31 -41.54 76.15 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.408 1.083 . . . . 0.0 112.951 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -88.35 -35.24 17.28 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.688 0.395 . . . . 0.0 110.708 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.59 20.55 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.427 0.691 . . . . 0.0 110.242 -178.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -64.9 93.24 0.11 Allowed 'General case' 0 C--N 1.354 0.789 0 C-N-CA 124.334 1.054 . . . . 0.0 109.982 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.527 ' HA ' ' N ' ' A' ' 67' ' ' SER . 1.5 pp20? -65.22 140.91 98.03 Favored Pre-proline 0 CA--C 1.554 1.121 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.612 -176.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -75.32 100.4 0.3 Allowed 'Cis proline' 0 C--N 1.385 2.471 0 CA-C-N 120.036 1.049 . . . . 0.0 112.386 -1.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.527 ' N ' ' HA ' ' A' ' 65' ' ' GLU . 42.4 t -86.72 -64.52 1.14 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.921 0.888 . . . . 0.0 108.803 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -83.0 123.07 29.1 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -75.55 -29.52 59.42 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.576 0.35 . . . . 0.0 110.257 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 49.2 m -78.8 97.93 6.11 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 121.047 0.451 . . . . 0.0 109.796 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 10.5 m -136.11 155.16 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.102 0.961 . . . . 0.0 110.14 176.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -139.0 9.06 2.54 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.555 171.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.5 m -79.05 100.8 7.51 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.126 0.97 . . . . 0.0 110.326 -176.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.63 124.19 49.32 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 123.8 0.84 . . . . 0.0 110.412 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -76.25 134.94 16.32 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.079 1.852 . . . . 0.0 111.882 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.9 t -78.73 84.47 4.81 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.671 0.748 . . . . 0.0 109.38 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -132.1 25.7 4.57 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.375 -176.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 11.0 t -106.77 34.1 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-O 122.353 1.073 . . . . 0.0 109.319 -172.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -80.44 146.55 31.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.901 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 71.64 13.33 74.67 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.05 -0.523 . . . . 0.0 113.22 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.4 t -87.28 -0.2 56.38 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.746 0.818 . . . . 0.0 111.195 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -85.22 50.23 1.91 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.815 0.846 . . . . 0.0 109.817 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -115.81 138.0 51.55 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.556 1.143 . . . . 0.0 109.314 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -126.43 143.2 51.26 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -164.61 110.15 0.98 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.194 0.598 . . . . 0.0 109.713 173.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -126.5 167.25 15.86 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.477 1.111 . . . . 0.0 108.947 175.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.0 m -92.38 167.91 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 120.97 0.414 . . . . 0.0 110.362 173.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.34 83.03 1.41 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 170.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.77 76.44 1.58 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.93 0.892 . . . . 0.0 112.224 -172.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.522 ' H ' ' HD3' ' A' ' 90' ' ' LYS . 0.3 OUTLIER -59.79 152.87 21.93 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.421 166.297 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.468 HG23 ' HB3' ' A' ' 93' ' ' ASP . 29.5 m -113.15 27.74 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 122.951 0.5 . . . . 0.0 110.93 -177.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.6 mt 55.21 25.11 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 125.565 1.546 . . . . 0.0 110.962 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.468 ' HB3' HG23 ' A' ' 91' ' ' VAL . 6.1 p-10 -65.68 94.85 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.652 1.181 . . . . 0.0 112.243 -171.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.1 tt 74.13 -29.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.574 1.549 . . . . 0.0 112.598 178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.3 t -63.87 103.91 0.63 Allowed 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 122.282 1.039 . . . . 0.0 112.35 -171.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -138.99 121.82 16.54 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 124.466 1.107 . . . . 0.0 108.253 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -80.29 75.8 7.1 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -77.46 145.74 36.9 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.999 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -67.32 155.67 38.32 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.634 0.584 . . . . 0.0 110.712 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -71.99 2.81 5.07 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 124.682 1.193 . . . . 0.0 112.604 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -53.25 -58.51 6.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.116 1.366 . . . . 0.0 112.567 -173.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -34.28 76.99 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.164 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -62.42 -39.38 93.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.596 0.758 . . . . 0.0 110.577 175.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.66 -42.46 67.5 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.253 0.971 . . . . 0.0 110.747 -175.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.43 -45.57 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.988 0.805 . . . . 0.0 111.295 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.8 mm -65.42 -46.24 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.321 0.649 . . . . 0.0 110.467 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.8 78.34 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.539 0.735 . . . . 0.0 111.224 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.98 -47.41 74.63 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -69.26 -24.46 63.98 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -177.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -83.64 -44.45 14.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.187 0.595 . . . . 0.0 111.429 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -76.8 -55.86 5.12 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -82.59 125.24 30.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.65 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.6 m -97.79 147.78 33.53 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.845 0.858 . . . . 0.0 109.713 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.04 142.19 86.68 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.36 2.04 . . . . 0.0 111.851 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -20.91 63.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.278 0.561 . . . . 0.0 110.481 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 14.6 mt -117.24 60.72 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 170.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -78.53 -36.62 44.54 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.573 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -157.93 90.13 1.05 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.8 t70 57.31 38.83 28.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.516 1.126 . . . . 0.0 110.55 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -74.46 -106.03 0.09 OUTLIER Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.487 -176.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -91.44 27.64 1.91 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.185 0.594 . . . . 0.0 110.971 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.81 -42.41 95.01 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.101 0.961 . . . . 0.0 111.733 -173.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.5 tp 67.24 78.43 0.25 Allowed 'General case' 0 C--O 1.242 0.705 0 O-C-N 124.944 1.403 . . . . 0.0 110.303 -173.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -107.48 90.73 3.39 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.189 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.405 ' HA ' ' HD3' ' A' ' 125' ' ' ARG . 20.2 mmt180 -139.25 -175.8 4.3 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.262 1.025 . . . . 0.0 109.956 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.28 169.02 21.74 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.773 0.829 . . . . 0.0 109.083 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.04 142.89 23.84 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -130.13 125.12 34.3 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.463 0.705 . . . . 0.0 109.511 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -172.09 122.35 0.48 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.34 1.456 . . . . 0.0 108.492 175.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 6.2 t -78.01 81.51 4.4 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-O 122.422 1.106 . . . . 0.0 110.593 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 26.8 m -73.81 107.79 6.26 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.292 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.03 0 C-N-CA 123.65 0.78 . . . . 0.0 110.348 -176.184 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 51.7 ttm -53.4 -57.66 9.84 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.987 0.915 . . . . 0.0 111.814 -177.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.0 pt? -57.05 -34.98 68.8 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.738 0.815 . . . . 0.0 112.08 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -64.76 -51.88 59.97 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.859 0.464 . . . . 0.0 110.069 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -62.47 -49.86 73.74 Favored 'General case' 0 N--CA 1.484 1.229 0 O-C-N 124.688 1.242 . . . . 0.0 110.498 -174.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -55.24 -54.96 36.78 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.793 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' A' ' 40' ' ' LEU . 14.6 tp -70.73 -40.78 72.56 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 123.342 0.401 . . . . 0.0 111.024 -175.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -54.91 -38.05 67.13 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.179 0.992 . . . . 0.0 111.272 176.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -75.71 -42.07 51.81 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.877 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 28' ' ' LEU . 27.7 pt -86.23 -10.15 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.454 HG22 HG23 ' A' ' 55' ' ' VAL . 77.6 p -103.77 -50.84 3.31 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.428 0.632 . . . . 0.0 109.868 173.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.52 -4.61 32.9 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.541 -174.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.538 HD12 HD13 ' A' ' 58' ' ' LEU . 73.8 mt -81.0 118.8 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 124.263 1.025 . . . . 0.0 110.4 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -84.12 -18.65 36.13 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.054 -178.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 13.9 t70 -69.06 119.61 71.09 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.53 0.732 . . . . 0.0 110.27 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -69.29 -29.58 25.9 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.766 2.311 . . . . 0.0 113.287 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -63.34 -48.72 76.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.086 0.554 . . . . 0.0 110.242 -176.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -55.46 -38.62 69.31 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 124.257 0.973 . . . . 0.0 111.454 177.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.591 ' HA ' HD23 ' A' ' 28' ' ' LEU . 45.5 mt -69.57 -46.87 65.38 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.872 0.733 . . . . 0.0 110.89 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.12 -43.39 98.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.191 0.596 . . . . 0.0 111.267 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.516 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 49.2 mt-10 -70.75 -30.39 66.89 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.612 0.765 . . . . 0.0 111.833 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.58 -42.99 60.86 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 123.379 0.424 . . . . 0.0 110.347 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.463 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -66.19 -29.8 70.15 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.826 0.85 . . . . 0.0 110.21 176.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.3 tmmm? -75.21 -43.28 52.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 110.48 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.15 77.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.331 0.652 . . . . 0.0 110.738 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.9 p -88.53 -6.74 57.4 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.46 0.704 . . . . 0.0 111.405 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.4 t30 66.48 13.18 9.15 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.083 1.353 . . . . 0.0 111.825 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.01 -14.79 5.42 Favored Glycine 0 C--N 1.351 1.394 0 CA-C-O 119.744 -0.476 . . . . 0.0 113.489 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -78.27 102.49 7.67 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.197 0.499 . . . . 0.0 109.935 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.1 tt -65.04 -27.01 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.5 m -68.26 -41.94 80.34 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 121.428 0.633 . . . . 0.0 110.348 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -72.27 -33.24 67.32 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.4 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.98 -51.05 70.88 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.541 0.736 . . . . 0.0 111.386 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.454 HG23 HG22 ' A' ' 32' ' ' THR . 7.7 p -64.01 -39.81 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.195 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.2 t -60.23 -33.22 71.96 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.525 0.516 . . . . 0.0 111.905 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 99.3 mt -77.93 -36.28 49.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.001 0.52 . . . . 0.0 111.522 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.538 HD13 HD12 ' A' ' 34' ' ' ILE . 73.2 mt -78.32 -18.44 55.19 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.465 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 70.6 p -104.47 11.04 34.94 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.205 0.602 . . . . 0.0 111.008 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.89 -27.73 69.35 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.792 0.837 . . . . 0.0 111.616 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.11 -30.05 62.13 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.748 -177.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 59' ' ' THR . 13.0 ptm180 -89.65 -8.75 51.78 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -124.3 79.59 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 CA-C-O 122.503 1.144 . . . . 0.0 109.386 174.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.46 ' NZ ' ' HB2' ' A' ' 64' ' ' LYS . 2.5 ttmp? -166.16 102.64 0.64 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.014 178.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -69.06 160.27 79.23 Favored Pre-proline 0 CA--C 1.566 1.567 0 C-N-CA 124.02 0.928 . . . . 0.0 111.383 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -88.9 102.49 0.34 Allowed 'Cis proline' 0 C--N 1.384 2.399 0 CA-C-N 120.138 1.085 . . . . 0.0 113.29 -5.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.2 m -67.77 -47.59 68.77 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 170.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -93.53 118.08 30.9 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.934 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -75.01 129.85 38.34 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 t -165.25 168.6 16.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.832 0.853 . . . . 0.0 109.382 -174.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.8 m -74.39 144.85 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 167.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.51 21.4 10.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.506 0.722 . . . . 0.0 111.046 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.6 m 65.89 28.57 10.66 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 125.014 1.325 . . . . 0.0 110.892 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.43 154.28 62.53 Favored Pre-proline 0 CA--C 1.554 1.107 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.619 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.0 -168.7 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.746 0 C-N-CA 122.409 2.073 . . . . 0.0 112.826 176.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.1 t -69.82 93.13 0.72 Allowed 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.259 0.552 . . . . 0.0 110.834 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -86.9 -17.79 32.4 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.836 0.854 . . . . 0.0 110.897 177.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 87.1 t -74.39 123.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 172.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.91 159.66 22.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.942 0.897 . . . . 0.0 111.445 -174.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -116.01 87.37 0.44 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.606 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.2 m -53.37 141.59 24.02 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.816 0.846 . . . . 0.0 111.977 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -83.1 71.7 10.14 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.685 0.794 . . . . 0.0 108.898 176.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.07 71.43 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.191 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 59.96 58.34 2.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.956 1.302 . . . . 0.0 112.019 170.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -102.99 130.25 50.02 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.018 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.53 145.39 49.16 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.913 . . . . 0.0 111.566 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 30.1 m -81.81 150.29 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.924 0.49 . . . . 0.0 110.459 173.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.2 pp -108.78 29.96 6.96 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.618 0.767 . . . . 0.0 110.901 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -85.83 153.0 22.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.711 0.804 . . . . 0.0 110.203 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 148.85 38.9 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.418 0.687 . . . . 0.0 109.715 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -122.91 24.66 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 CA-C-O 121.293 0.568 . . . . 0.0 110.798 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.6 mm 50.06 70.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 CA-C-O 122.855 1.312 . . . . 0.0 109.353 -172.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -120.31 29.87 7.26 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 113.509 -1.678 . . . . 0.0 110.152 -172.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 pp -87.49 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.663 1.185 . . . . 0.0 111.415 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.6 p -68.3 127.85 34.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.743 0.817 . . . . 0.0 110.628 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -91.34 146.15 24.05 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.462 0.705 . . . . 0.0 110.685 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.64 156.8 28.96 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.529 175.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -68.22 117.62 10.27 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.734 0.814 . . . . 0.0 110.258 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.554 ' HG3' ' H ' ' A' ' 101' ' ' ASP . 17.4 tppt? -62.16 144.26 55.65 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.993 0.917 . . . . 0.0 111.461 -173.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.55 0.77 13.78 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.445 1.098 . . . . 0.0 112.596 -177.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.554 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 21.0 t70 -54.38 -70.51 0.1 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.8 1.24 . . . . 0.0 111.906 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -30.52 69.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.225 0.61 . . . . 0.0 112.053 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -65.62 -48.24 72.92 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.028 0.531 . . . . 0.0 110.158 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.04 70.35 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.626 0.579 . . . . 0.0 111.12 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -56.16 20.05 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.085 0.554 . . . . 0.0 111.013 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -72.8 -41.92 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.324 0.65 . . . . 0.0 110.673 -175.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.35 96.15 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.944 0.498 . . . . 0.0 111.554 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 54.5 tp -63.6 -46.68 84.7 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -59.37 -24.73 63.65 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.17 0.588 . . . . 0.0 112.406 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.78 -44.4 49.73 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.75 -8.75 59.44 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.888 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 108' ' ' LEU . 12.2 mm-40 -68.26 149.06 49.93 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.052 0.453 . . . . 0.0 110.139 173.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.2 m -115.85 155.29 47.91 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.111 0.964 . . . . 0.0 110.41 -171.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.79 131.11 35.84 Favored 'Trans proline' 0 C--N 1.381 2.262 0 C-N-CA 122.051 1.834 . . . . 0.0 110.946 172.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -67.44 -45.15 76.87 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 116' ' ' ILE . 2.2 mp -86.29 114.76 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 168.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -56.18 -33.87 65.68 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.938 0.895 . . . . 0.0 113.366 -171.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' A' ' 121' ' ' ARG . . . -81.94 84.56 6.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.864 0.466 . . . . 0.0 110.363 175.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 63.12 3.05 1.18 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 124.858 1.263 . . . . 0.0 114.029 170.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 74.19 64.4 2.42 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 117.933 0.333 . . . . 0.0 112.921 -173.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.548 ' HG2' ' O ' ' A' ' 118' ' ' ALA . 31.2 mmt180 -83.57 37.74 0.59 Allowed 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.303 0.641 . . . . 0.0 111.911 176.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -55.06 -37.25 66.51 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.893 0.877 . . . . 0.0 112.373 176.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tt -138.99 72.8 1.41 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -164.54 163.93 21.86 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.546 -1.207 . . . . 0.0 108.672 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 63.02 28.48 16.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.558 1.143 . . . . 0.0 111.68 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ptm -90.82 5.1 49.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.83 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -151.45 154.39 36.5 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.496 0.719 . . . . 0.0 110.106 176.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.498 ' HG2' HG22 ' A' ' 130' ' ' THR . 41.6 tt0 -162.77 105.56 1.07 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 0.0 108.413 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -82.03 92.47 6.8 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.979 0.511 . . . . 0.0 110.882 -177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' THR . . . . . 0.498 HG22 ' HG2' ' A' ' 128' ' ' GLU . 12.6 t -170.33 174.4 5.28 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.946 0.898 . . . . 0.0 110.165 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 32.8 m -103.9 142.55 34.21 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.733 0.813 . . . . 0.0 110.418 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.96 0 C-N-CA 124.099 0.96 . . . . 0.0 109.223 179.393 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.7 tp-100 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.7 ttt -55.52 -48.41 74.71 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.721 0.808 . . . . 0.0 112.233 -172.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.574 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -56.67 -38.86 72.79 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.728 0.811 . . . . 0.0 112.27 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.574 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -65.3 -46.11 81.71 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -63.23 -44.74 94.39 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 124.418 1.074 . . . . 0.0 111.271 -177.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -55.55 33.4 Favored 'General case' 0 C--N 1.349 0.55 0 O-C-N 124.532 1.145 . . . . 0.0 110.075 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 40' ' ' LEU . 13.8 tp -66.61 -44.9 80.86 Favored 'General case' 0 C--N 1.351 0.665 0 O-C-N 124.213 0.946 . . . . 0.0 111.125 -174.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -56.93 -38.8 73.39 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.419 1.088 . . . . 0.0 111.605 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -71.62 -49.62 38.46 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.753 0.658 . . . . 0.0 110.641 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.488 HD11 HD12 ' A' ' 28' ' ' LEU . 14.6 pt -74.93 -30.21 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.3 p -87.2 -48.21 8.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.892 0.477 . . . . 0.0 110.152 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.37 4.92 54.82 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.665 -174.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.64 HD12 HD13 ' A' ' 58' ' ' LEU . 72.7 mt -84.85 124.8 40.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.865 0.866 . . . . 0.0 110.463 -177.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -90.21 -12.25 38.61 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.247 1.019 . . . . 0.0 112.61 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 8.0 m-20 -72.05 109.09 5.03 Favored Pre-proline 0 N--CA 1.475 0.816 0 O-C-N 123.787 0.68 . . . . 0.0 109.688 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -63.73 -28.64 68.64 Favored 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.0 2.466 . . . . 0.0 111.413 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.3 m -58.28 -51.98 67.49 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.118 0.967 . . . . 0.0 110.537 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -60.05 -34.42 73.38 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.718 0.807 . . . . 0.0 111.263 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.682 ' HA ' HD23 ' A' ' 28' ' ' LEU . 51.9 mt -69.88 -52.38 25.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.778 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -57.04 -49.84 74.6 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.751 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.4 -38.91 91.47 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.387 0.675 . . . . 0.0 112.373 -173.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.62 -42.2 82.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.462 0.476 . . . . 0.0 110.809 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.433 HD23 HD22 ' A' ' 28' ' ' LEU . 3.7 mm? -63.76 -32.8 74.42 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.856 0.862 . . . . 0.0 111.31 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 mpmm? -75.75 -41.61 52.76 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.836 0.454 . . . . 0.0 110.461 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.29 -27.28 67.04 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.07 0.948 . . . . 0.0 111.14 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -101.83 -1.63 31.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.792 0.837 . . . . 0.0 111.705 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 m120 64.68 16.97 10.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.964 1.306 . . . . 0.0 112.283 178.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.76 -13.57 13.1 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-O 119.51 -0.605 . . . . 0.0 113.126 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.4 109.05 5.14 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 109.773 -178.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.76 -28.94 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.591 0.756 . . . . 0.0 111.601 -172.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.7 m -71.85 -45.34 61.75 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.092 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.413 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.8 mm-40 -65.45 -40.44 93.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.876 0.471 . . . . 0.0 110.158 174.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.1 75.35 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.008 0.923 . . . . 0.0 111.869 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.2 p -64.73 -39.31 85.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.661 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.533 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.8 m -62.34 -36.55 82.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.384 0.673 . . . . 0.0 112.242 178.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.4 mt -71.64 -33.81 69.24 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.448 0.699 . . . . 0.0 111.007 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.64 HD13 HD12 ' A' ' 34' ' ' ILE . 79.6 mt -84.08 -26.68 28.82 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 176.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.436 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 82.8 p -96.27 12.59 30.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.098 0.559 . . . . 0.0 110.799 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -66.02 -17.74 64.88 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.903 0.881 . . . . 0.0 110.517 169.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.36 -27.9 61.75 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.554 1.141 . . . . 0.0 112.201 -177.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 59' ' ' THR . 37.3 ptt180 -61.79 -32.26 72.53 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.448 0.642 . . . . 0.0 110.316 176.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.5 p -119.3 32.57 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.821 1.248 . . . . 0.0 108.66 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -61.09 89.46 0.02 OUTLIER 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.069 0.948 . . . . 0.0 110.214 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -61.92 128.42 90.58 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.206 1.002 . . . . 0.0 110.958 -173.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -84.04 106.42 0.86 Allowed 'Cis proline' 0 C--N 1.381 2.281 0 C-N-CA 124.982 -0.841 . . . . 0.0 113.618 3.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.9 t -104.5 143.2 33.36 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.605 0.762 . . . . 0.0 109.742 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.04 -10.73 12.82 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.739 0.816 . . . . 0.0 111.447 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.91 -49.65 76.84 Favored 'General case' 0 C--N 1.362 1.121 0 C-N-CA 123.534 0.733 . . . . 0.0 110.29 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.0 p -110.3 142.9 41.28 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.6 t -67.62 102.15 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.21 68.28 2.6 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.051 0.94 . . . . 0.0 110.109 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.2 m -147.47 97.52 2.86 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 124.493 1.117 . . . . 0.0 108.404 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -112.32 159.55 33.53 Favored Pre-proline 0 CA--C 1.549 0.929 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -47.1 106.99 0.11 Allowed 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 123.466 2.777 . . . . 0.0 112.827 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.5 m -76.78 82.84 3.38 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.704 0.764 . . . . 0.0 110.004 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.27 17.44 16.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.886 1.274 . . . . 0.0 109.704 -177.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 18.7 m -58.11 134.62 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 124.574 1.15 . . . . 0.0 112.039 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.97 107.93 10.87 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.191 0.596 . . . . 0.0 109.583 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.99 82.68 0.54 Allowed Glycine 0 C--N 1.339 0.733 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.83 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.0 t -68.76 140.21 55.33 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.434 0.694 . . . . 0.0 110.727 178.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -126.16 77.39 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.761 0.824 . . . . 0.0 109.702 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.26 38.4 1.26 Allowed 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.909 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -61.66 120.2 10.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.407 1.083 . . . . 0.0 111.249 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -155.63 136.4 13.5 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 175.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -125.67 133.97 52.0 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.3 m -69.23 159.84 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.19 0.596 . . . . 0.0 111.117 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.1 mp -89.27 19.64 4.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.717 0.807 . . . . 0.0 110.562 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -91.77 117.11 29.47 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 123.965 0.906 . . . . 0.0 109.671 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -160.1 168.05 26.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.843 0.857 . . . . 0.0 109.139 -178.1 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.46 5.91 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 CA-C-O 121.856 0.836 . . . . 0.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.404 ' H ' ' HG2' ' A' ' 90' ' ' LYS . 35.0 mt -89.46 72.52 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.304 1.042 . . . . 0.0 108.948 -173.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -93.73 147.06 23.39 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.246 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -148.26 39.96 0.93 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.378 0.671 . . . . 0.0 111.681 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 37.8 p -74.27 -64.27 1.06 Allowed 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.922 0.489 . . . . 0.0 111.858 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -98.27 18.23 16.82 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.222 0.609 . . . . 0.0 110.926 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -82.62 60.31 5.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.811 0.845 . . . . 0.0 110.788 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -108.76 131.45 54.94 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.534 ' HG3' ' H ' ' A' ' 101' ' ' ASP . 26.7 tptp -79.12 145.58 33.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.941 0.496 . . . . 0.0 110.063 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -77.22 -6.05 51.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.754 0.821 . . . . 0.0 111.586 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.534 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 26.7 t70 -59.45 -66.73 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.198 0.999 . . . . 0.0 111.052 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.428 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -66.47 -32.46 73.84 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.297 0.998 . . . . 0.0 111.704 -178.292 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -58.7 -57.32 13.54 Favored 'General case' 0 C--N 1.359 0.99 0 O-C-N 123.877 0.736 . . . . 0.0 110.368 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.82 -25.44 61.14 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.45 1.094 . . . . 0.0 111.386 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.81 -57.96 8.28 Favored 'General case' 0 C--N 1.354 0.779 0 C-N-CA 123.135 0.574 . . . . 0.0 110.156 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.26 -39.89 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.439 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -54.6 -59.1 5.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.021 0.928 . . . . 0.0 110.82 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 43.9 tp -67.73 -34.39 76.75 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.119 0.887 . . . . 0.0 111.398 -177.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.1 t -66.4 -30.16 70.48 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 122.381 0.272 . . . . 0.0 111.443 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 43.3 mt -83.48 -24.6 31.68 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.769 0.828 . . . . 0.0 110.96 175.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 87.2 mt -77.07 -19.67 56.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.186 0.594 . . . . 0.0 110.475 170.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -110.34 25.75 11.44 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.482 1.113 . . . . 0.0 109.947 176.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 p -54.85 120.79 30.78 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.555 0.742 . . . . 0.0 110.542 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.02 152.61 69.97 Favored 'Trans proline' 0 C--N 1.376 2.0 0 C-N-CA 122.969 2.446 . . . . 0.0 112.613 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -86.63 11.34 13.09 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.356 0.662 . . . . 0.0 110.111 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.464 HD12 ' HA ' ' A' ' 122' ' ' ASP . 5.6 tt -135.16 105.27 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.861 1.264 . . . . 0.0 108.468 175.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -107.75 -24.89 11.52 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.707 0.803 . . . . 0.0 109.749 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -152.65 72.38 0.97 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.321 1.048 . . . . 0.0 109.16 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 62.7 28.3 16.49 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.603 1.161 . . . . 0.0 112.276 176.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.91 -104.19 0.02 OUTLIER Glycine 0 C--N 1.359 1.827 0 CA-C-O 120.007 -0.329 . . . . 0.0 112.675 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -84.04 81.84 8.61 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.616 0.722 . . . . 0.0 109.059 175.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.464 ' HA ' HD12 ' A' ' 116' ' ' ILE . 31.6 t70 -62.01 -35.02 77.31 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.193 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.21 -22.23 66.87 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.378 0.671 . . . . 0.0 112.389 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -79.32 90.49 4.98 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -156.5 170.08 23.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.678 1.191 . . . . 0.0 108.855 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 43.2 tpp -150.08 128.21 11.97 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.165 0.586 . . . . 0.0 110.264 -177.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -129.56 105.91 8.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.279 1.031 . . . . 0.0 108.577 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.45 -165.85 2.33 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.1 0.96 . . . . 0.0 109.684 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.46 75.0 4.02 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.322 0.649 . . . . 0.0 111.879 -177.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.2 t -104.32 90.01 3.42 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 121.657 0.741 . . . . 0.0 109.143 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.4 t -165.08 154.94 13.26 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.396 0.678 . . . . 0.0 109.759 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 C-N-CA 123.785 0.834 . . . . 0.0 109.152 178.155 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 110.657 -0.127 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.0 tpt -52.61 -52.39 55.58 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.22 1.008 . . . . 0.0 111.951 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.507 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.5 pt? -62.54 -33.54 75.13 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.995 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.2 -49.45 71.95 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.164 0.586 . . . . 0.0 109.938 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -69.3 -42.33 75.59 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.73 -174.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 46.7 mm-40 -56.26 -54.34 46.49 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.364 1.065 . . . . 0.0 110.727 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.521 HD23 ' HA ' ' A' ' 40' ' ' LEU . 15.2 tp -65.08 -42.2 94.34 Favored 'General case' 0 C--N 1.357 0.922 0 O-C-N 123.496 0.498 . . . . 0.0 111.285 -177.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -57.29 -37.63 72.71 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.209 1.004 . . . . 0.0 111.4 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.45 -48.37 56.27 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.336 0.654 . . . . 0.0 111.161 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 17.7 pt -82.51 -16.18 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 74.9 p -96.05 -48.01 5.86 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.111 0.481 . . . . 0.0 109.874 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -9.87 47.33 Favored Glycine 0 N--CA 1.468 0.816 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.026 -173.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.422 HD12 ' HB3' ' A' ' 58' ' ' LEU . 88.1 mt -75.85 112.11 13.11 Favored 'Isoleucine or valine' 0 C--N 1.348 0.538 0 C-N-CA 124.202 1.001 . . . . 0.0 110.351 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -79.49 -14.92 58.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 9.4 t70 -78.17 116.33 58.03 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.07 0.948 . . . . 0.0 110.336 -175.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.01 -23.43 34.21 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.924 2.416 . . . . 0.0 113.456 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.0 m -62.31 -50.15 72.77 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.073 0.549 . . . . 0.0 110.061 -177.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.8 -38.36 78.42 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 125.112 1.507 . . . . 0.0 111.318 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 28' ' ' LEU . 43.1 mt -67.67 -46.55 72.03 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.199 0.937 . . . . 0.0 111.111 -176.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -62.27 -46.06 90.49 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.667 0.604 . . . . 0.0 111.022 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.509 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 47.2 mt-10 -65.15 -31.2 72.27 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.497 0.719 . . . . 0.0 112.16 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -43.81 64.58 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.676 0.61 . . . . 0.0 110.43 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.507 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.2 mm? -68.58 -27.05 65.72 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 0.0 110.349 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.7 tmmm? -75.38 -45.2 40.62 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.255 1.022 . . . . 0.0 110.309 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.22 -30.29 68.42 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.443 0.697 . . . . 0.0 111.274 -177.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.08 2.79 56.06 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.724 0.81 . . . . 0.0 112.123 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 67.65 11.74 8.52 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.842 1.257 . . . . 0.0 111.866 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.05 2.25 22.08 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 123.537 0.589 . . . . 0.0 113.55 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -88.17 110.26 20.55 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.352 0.596 . . . . 0.0 110.666 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.4 tt -67.99 -18.94 24.22 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.798 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 m -71.08 -50.55 32.54 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.456 0.703 . . . . 0.0 111.008 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.4 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 27.3 mm-40 -64.66 -38.64 91.69 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.903 174.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.68 62.59 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.127 0.892 . . . . 0.0 112.527 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -65.06 -41.15 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 O-C-N 123.583 0.552 . . . . 0.0 110.888 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.8 t -59.41 -42.7 92.4 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.612 0.57 . . . . 0.0 111.227 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 85.9 mt -71.18 -38.14 72.14 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.049 0.54 . . . . 0.0 111.559 -177.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.422 ' HB3' HD12 ' A' ' 34' ' ' ILE . 37.8 mt -76.78 -26.43 54.49 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.8 p -85.05 -40.65 16.58 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.163 0.438 . . . . 0.0 110.877 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.496 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . 61.9 m-20 -77.62 19.69 0.36 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.32 -20.92 63.88 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-O 120.986 0.422 . . . . 0.0 109.996 160.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.496 ' HG2' ' HA ' ' A' ' 60' ' ' ASP . 30.3 ptt180 -58.94 -36.19 74.37 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 125.186 1.394 . . . . 0.0 111.874 171.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.1 p -102.81 15.88 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.684 0.793 . . . . 0.0 110.881 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -62.28 105.82 0.66 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.444 0.697 . . . . 0.0 109.829 170.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -52.22 135.99 40.12 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 125.053 1.341 . . . . 0.0 112.513 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -82.82 113.98 3.11 Favored 'Cis proline' 0 C--N 1.381 2.246 0 C-N-CA 124.566 -1.014 . . . . 0.0 111.291 -1.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 56.4 p -100.25 -87.37 0.37 Allowed 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -178.83 164.71 1.55 Allowed 'General case' 0 C--O 1.246 0.916 0 C-N-CA 124.168 0.987 . . . . 0.0 110.147 -171.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.26 133.17 36.71 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 168.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.9 p -93.49 93.42 8.1 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.306 0.643 . . . . 0.0 111.121 -173.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.1 m -82.45 147.22 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.383 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.93 76.34 9.77 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.2 m -152.87 154.96 36.16 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 124.426 1.091 . . . . 0.0 109.123 -173.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -66.52 128.65 93.96 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 122.987 0.515 . . . . 0.0 109.674 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -69.95 151.79 68.1 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 122.66 2.24 . . . . 0.0 112.147 174.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.7 t -77.26 168.88 19.31 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.195 0.598 . . . . 0.0 110.148 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -69.52 87.83 0.48 Allowed 'General case' 0 C--N 1.349 0.576 0 C-N-CA 123.292 0.637 . . . . 0.0 110.991 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.1 p -113.19 107.41 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.546 1.138 . . . . 0.0 109.398 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -103.27 139.11 39.15 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.884 0.874 . . . . 0.0 108.947 178.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.49 31.33 3.77 Favored Glycine 0 C--N 1.347 1.158 0 O-C-N 123.478 0.486 . . . . 0.0 112.942 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -66.49 90.23 0.16 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.606 0.763 . . . . 0.0 110.8 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.37 -2.06 43.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.199 1.0 . . . . 0.0 111.038 177.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.73 144.26 51.0 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.735 0.814 . . . . 0.0 111.229 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -90.66 37.44 0.92 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.676 0.791 . . . . 0.0 110.33 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -64.46 146.05 55.14 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 123.943 0.897 . . . . 0.0 110.234 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -61.98 104.07 0.42 Allowed 'General case' 0 C--O 1.245 0.862 0 O-C-N 123.833 0.708 . . . . 0.0 109.423 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 27.1 m -73.95 142.92 14.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.715 177.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.37 15.78 19.1 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.731 0.813 . . . . 0.0 109.761 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.07 165.25 9.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.396 1.078 . . . . 0.0 112.715 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.447 ' H ' ' HD3' ' A' ' 90' ' ' LYS . 0.1 OUTLIER -51.51 148.51 5.11 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.225 1.01 . . . . 0.0 111.822 175.802 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.3 m -121.85 23.87 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 CA-C-O 121.967 0.889 . . . . 0.0 110.009 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.553 HG13 ' H ' ' A' ' 129' ' ' ALA . 40.7 mm -105.95 80.15 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.114 -171.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -124.93 147.27 48.94 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.937 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -144.23 16.76 1.71 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.531 0.733 . . . . 0.0 110.895 -173.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.3 p -78.22 -167.12 0.95 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.919 0.39 . . . . 0.0 110.949 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -82.16 10.32 7.0 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.7 121.71 18.46 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 123.015 0.526 . . . . 0.0 110.571 175.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -85.73 165.92 16.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.372 0.669 . . . . 0.0 111.017 178.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.503 ' HE3' ' HB2' ' A' ' 101' ' ' ASP . 58.6 tttp -164.06 149.03 10.34 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.665 1.186 . . . . 0.0 107.993 -172.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -98.15 -20.67 17.16 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 122.485 0.314 . . . . 0.0 111.492 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.503 ' HB2' ' HE3' ' A' ' 99' ' ' LYS . 4.7 m-20 -65.23 -47.09 78.03 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.17 0.588 . . . . 0.0 112.185 -173.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -32.15 72.44 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.437 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -66.15 -44.85 82.94 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.94 0.496 . . . . 0.0 110.393 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.96 90.54 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.011 0.819 . . . . 0.0 110.677 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -57.76 11.33 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.206 1.003 . . . . 0.0 111.83 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.2 mm -64.47 -42.18 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.926 0.891 . . . . 0.0 111.188 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.78 88.65 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.342 0.657 . . . . 0.0 111.528 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.01 -45.65 80.77 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -67.69 -27.78 67.12 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.614 0.765 . . . . 0.0 111.908 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.9 tt -81.14 -45.85 15.8 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.85 0.86 . . . . 0.0 109.889 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.4 tt -88.6 -59.35 2.26 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.311 0.645 . . . . 0.0 109.319 -172.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -80.28 164.6 23.07 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.116 0.566 . . . . 0.0 109.74 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.0 m -80.37 118.69 73.61 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 123.22 0.608 . . . . 0.0 109.511 174.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.36 157.52 60.87 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.023 2.482 . . . . 0.0 110.972 173.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.532 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 11.0 mmpt? -84.07 80.87 9.03 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.552 0.692 . . . . 0.0 109.983 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.434 HG12 ' HB2' ' A' ' 121' ' ' ARG . 22.4 mt -134.59 63.63 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -87.35 -45.26 10.73 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 121.297 0.57 . . . . 0.0 109.773 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -148.5 14.38 0.97 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.771 1.229 . . . . 0.0 108.937 175.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -80.39 -41.88 23.83 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 124.671 1.188 . . . . 0.0 110.364 -175.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.46 38.04 79.4 Favored Glycine 0 C--N 1.348 1.197 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.731 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.434 ' HB2' HG12 ' A' ' 116' ' ' ILE . 78.8 mtp180 -86.55 7.33 26.63 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.474 0.71 . . . . 0.0 111.248 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.21 -36.06 83.02 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.939 0.896 . . . . 0.0 111.937 -178.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 4.8 tt -126.58 107.44 10.22 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -127.25 101.88 6.68 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 176.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -67.71 119.6 12.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.361 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -67.41 108.86 2.95 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 34.9 p-80 -61.1 139.57 58.06 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.963 0.505 . . . . 0.0 110.863 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.09 146.72 45.57 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.554 0.693 . . . . 0.0 111.252 -176.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.553 ' H ' HG13 ' A' ' 92' ' ' ILE . . . -126.2 46.08 2.51 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 168.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 54.7 m -52.99 97.23 0.02 OUTLIER 'General case' 0 C--N 1.365 1.266 0 CA-C-N 113.989 -1.459 . . . . 0.0 112.101 -174.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 30.7 m -77.55 78.65 4.06 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.745 0.818 . . . . 0.0 109.707 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 C-N-CA 123.702 0.801 . . . . 0.0 108.989 178.775 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 . . . . . 0 N--CA 1.483 1.195 0 CA-C-O 119.316 -0.373 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.1 ttt -51.55 -51.99 50.82 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.826 0.851 . . . . 0.0 111.935 -175.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.592 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -52.48 -39.86 61.68 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.466 0.707 . . . . 0.0 112.605 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.592 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.1 mm? -62.55 -51.99 65.18 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -60.14 -46.28 90.18 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.553 1.158 . . . . 0.0 111.809 -174.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -62.26 -55.86 24.24 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 124.138 0.899 . . . . 0.0 110.596 -178.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -62.38 -49.44 75.54 Favored 'General case' 0 C--N 1.356 0.865 0 O-C-N 123.806 0.691 . . . . 0.0 111.019 -176.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -57.27 -34.4 68.61 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.648 1.179 . . . . 0.0 111.493 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.76 -54.07 26.57 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.558 175.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.0 pt -88.5 -6.47 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -167.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 p -105.49 -40.11 5.9 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.306 0.643 . . . . 0.0 109.535 171.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.72 1.8 67.78 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.982 -176.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.573 HD12 HD13 ' A' ' 58' ' ' LEU . 67.1 mt -78.98 122.21 33.74 Favored 'Isoleucine or valine' 0 C--N 1.348 0.516 0 C-N-CA 123.939 0.896 . . . . 0.0 111.262 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 72.4 mm-40 -83.05 -21.0 33.92 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.985 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 10.5 m-20 -66.87 109.13 3.03 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 123.793 0.837 . . . . 0.0 110.061 -177.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -69.17 -29.54 26.51 Favored 'Trans proline' 0 C--N 1.373 1.85 0 C-N-CA 122.512 2.142 . . . . 0.0 111.763 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 m -61.4 -43.07 99.5 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.284 0.634 . . . . 0.0 109.909 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -60.73 -39.15 87.58 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 123.404 0.44 . . . . 0.0 110.36 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.613 ' HA ' HD23 ' A' ' 28' ' ' LEU . 62.0 mt -67.72 -52.85 32.82 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 124.19 0.931 . . . . 0.0 111.499 -175.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -62.36 -49.73 74.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.697 0.399 . . . . 0.0 111.54 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -65.33 -26.77 68.19 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.978 0.511 . . . . 0.0 111.878 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.23 -45.24 70.28 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.618 0.367 . . . . 0.0 110.502 171.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.468 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -66.31 -23.15 66.33 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.555 0.742 . . . . 0.0 111.091 175.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mpmm? -75.62 -45.37 37.81 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.363 0.665 . . . . 0.0 109.425 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -12.88 61.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.861 0.864 . . . . 0.0 112.048 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 98.5 p -110.44 -4.68 15.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.366 0.667 . . . . 0.0 111.725 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 65.05 20.88 12.17 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.551 1.14 . . . . 0.0 112.08 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.88 2.57 32.08 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-O 119.543 -0.587 . . . . 0.0 113.318 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -89.42 115.63 27.01 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.009 0.523 . . . . 0.0 110.305 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.556 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.6 tp -62.38 -39.13 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.468 0.307 . . . . 0.0 111.774 -173.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.1 m -66.05 -47.66 73.64 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.795 0.838 . . . . 0.0 110.89 -172.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -65.44 -36.79 84.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.239 0.615 . . . . 0.0 110.858 177.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -44.75 87.06 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 123.586 0.554 . . . . 0.0 111.336 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 51' ' ' ILE . 38.9 t -62.1 -49.3 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.866 177.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 m -54.55 -45.84 73.52 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.136 0.974 . . . . 0.0 111.762 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -71.49 -34.19 69.92 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.124 -175.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.573 HD13 HD12 ' A' ' 34' ' ' ILE . 62.8 mt -72.77 -45.52 58.19 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 175.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.1 p -70.88 -12.31 61.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.481 0.713 . . . . 0.0 112.012 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' A' ' 63' ' ' VAL . 27.2 t70 -58.7 -18.83 34.55 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.712 0.805 . . . . 0.0 111.866 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -51.09 -35.56 35.66 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.41 1.084 . . . . 0.0 112.517 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -109.89 -19.61 13.05 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.081 0.953 . . . . 0.0 111.223 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.48 ' HB ' ' HA ' ' A' ' 60' ' ' ASP . 97.6 t -79.19 -28.94 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.069 0.547 . . . . 0.0 111.518 -176.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -64.64 101.65 0.49 Allowed 'General case' 0 CA--C 1.562 1.436 0 CA-C-O 122.098 0.951 . . . . 0.0 110.197 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.19 141.89 58.5 Favored Pre-proline 0 CA--C 1.563 1.459 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.407 -178.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -85.88 117.0 4.13 Favored 'Cis proline' 0 C--N 1.378 2.1 0 C-N-CA 124.451 -1.062 . . . . 0.0 111.831 -6.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -63.35 -50.01 71.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.554 0.741 . . . . 0.0 110.347 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -116.52 169.56 9.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.402 177.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -67.21 -46.39 73.98 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.158 0.504 . . . . 0.0 110.098 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 p -87.92 114.3 24.4 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.792 175.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 33.8 m -77.89 -176.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 122.904 0.481 . . . . 0.0 109.994 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.48 38.06 0.6 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.362 0.665 . . . . 0.0 111.88 -177.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.5 m 56.19 26.47 10.35 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.825 1.25 . . . . 0.0 111.009 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -84.64 151.38 58.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.739 -170.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.6 157.65 48.37 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.23 1.954 . . . . 0.0 111.292 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.3 m -127.67 82.12 2.07 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.419 0.688 . . . . 0.0 110.42 -175.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -108.84 66.34 0.63 Allowed 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.495 1.14 . . . . 0.0 108.954 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.0 t -77.07 130.8 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.198 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -60.31 110.21 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.783 0.677 . . . . 0.0 110.647 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 164.62 51.55 0.02 OUTLIER Glycine 0 C--N 1.336 0.573 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.896 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 56.3 m -62.31 94.71 0.06 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.164 0.586 . . . . 0.0 110.424 175.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.64 -33.55 69.0 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.926 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -77.59 147.1 35.83 Favored 'General case' 0 C--O 1.243 0.763 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.351 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -64.15 115.31 4.86 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -158.28 86.82 0.89 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.325 0.583 . . . . 0.0 110.165 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.91 -177.75 3.46 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.613 173.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 m -75.21 177.85 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 123.41 0.684 . . . . 0.0 110.485 172.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -81.77 59.28 4.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 110.349 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.5 112.62 24.39 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.65 0.78 . . . . 0.0 110.094 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.457 ' N ' ' HD3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -158.53 153.25 24.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.2 t -108.72 26.31 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 122.623 1.202 . . . . 0.0 109.119 177.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 42.8 mm -109.27 75.45 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -158.51 22.04 0.23 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.956 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 pp -86.85 63.85 8.18 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 122.305 1.05 . . . . 0.0 109.235 177.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.4 p -71.25 150.47 45.2 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.275 -1.33 . . . . 0.0 110.816 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 71.49 9.68 6.45 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 124.891 1.276 . . . . 0.0 111.163 -178.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -82.77 126.85 32.86 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.748 0.819 . . . . 0.0 109.717 175.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -158.57 153.13 24.47 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.952 0.901 . . . . 0.0 109.262 178.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.611 ' HD2' ' HB3' ' A' ' 101' ' ' ASP . 2.7 ttmp? -96.94 160.04 14.57 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -98.08 14.28 28.06 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.287 0.635 . . . . 0.0 111.455 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.611 ' HB3' ' HD2' ' A' ' 99' ' ' LYS . 8.0 p-10 -70.51 -43.93 68.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.996 0.518 . . . . 0.0 112.015 -170.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.404 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -72.9 -26.87 61.57 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.757 -178.611 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -64.68 -44.59 89.86 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.496 0.318 . . . . 0.0 110.323 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.39 91.45 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.665 0.603 . . . . 0.0 111.211 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.22 75.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.761 0.824 . . . . 0.0 111.965 -177.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 43.9 mm -68.39 -38.97 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 110.764 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.27 97.27 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.962 0.505 . . . . 0.0 111.187 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.82 -45.8 87.97 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.605 176.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.7 t -66.37 -26.9 67.48 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.044 0.937 . . . . 0.0 111.798 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -80.58 -44.91 18.2 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.299 0.64 . . . . 0.0 109.799 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.8 mp -80.15 -62.98 1.51 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.857 0.463 . . . . 0.0 110.308 -176.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -101.11 177.38 4.96 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.9 p -136.43 148.85 65.7 Favored Pre-proline 0 CA--C 1.543 0.692 0 C-N-CA 123.59 0.756 . . . . 0.0 109.052 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -56.9 126.97 23.95 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.981 2.454 . . . . 0.0 112.609 -176.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -68.49 -15.93 63.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.611 0.765 . . . . 0.0 111.233 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.42 ' HA ' ' HA ' ' A' ' 122' ' ' ASP . 58.7 mt -61.48 106.02 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 123.087 0.555 . . . . 0.0 109.54 171.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.87 -20.28 42.63 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.696 0.799 . . . . 0.0 111.649 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -105.53 -163.76 0.97 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.846 0.858 . . . . 0.0 110.905 -178.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -65.97 -35.12 79.72 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.209 0.604 . . . . 0.0 110.817 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -161.38 16.67 0.17 Allowed Glycine 0 C--N 1.346 1.084 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.942 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -112.17 118.04 34.25 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 5.1 p-10 -91.26 16.81 9.25 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.637 0.775 . . . . 0.0 110.651 168.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.5 mp -73.26 77.17 1.32 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.178 0.991 . . . . 0.0 109.662 178.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -84.89 99.14 10.74 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.729 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -84.01 93.73 8.14 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.691 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -131.97 -59.8 0.93 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.812 0.845 . . . . 0.0 108.896 -179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 44.0 t60 -124.97 106.91 10.32 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 174.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -131.67 168.49 17.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.282 1.033 . . . . 0.0 108.901 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.72 93.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.308 0.643 . . . . 0.0 110.237 170.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 33.4 p -71.9 96.26 1.66 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.238 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 47.0 t -58.85 122.31 13.3 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.246 1.018 . . . . 0.0 111.454 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 0.983 0 C-N-CA 123.571 0.749 . . . . 0.0 110.432 179.98 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -57.23 -34.44 68.57 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.694 0.797 . . . . 0.0 112.109 -174.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.556 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -59.15 -41.71 88.97 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.2 0.6 . . . . 0.0 112.178 177.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.556 HD22 ' HG ' ' A' ' 24' ' ' LEU . 2.7 mm? -72.78 -44.91 60.98 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.104 0.161 . . . . 0.0 110.657 177.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -59.27 -51.12 71.31 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 124.071 0.857 . . . . 0.0 111.124 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -66.37 -46.98 74.85 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.11 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.489 HD22 ' CD2' ' A' ' 44' ' ' LEU . 19.0 tp -56.19 -49.99 72.5 Favored 'General case' 0 C--N 1.368 1.382 0 O-C-N 123.647 0.592 . . . . 0.0 110.428 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -54.43 -40.44 68.33 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.797 1.239 . . . . 0.0 111.546 177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.89 -46.74 73.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.917 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 pt -93.38 1.59 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -170.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.513 HG21 HD12 ' A' ' 58' ' ' LEU . 68.6 p -117.83 -41.11 2.94 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.089 0.556 . . . . 0.0 110.363 171.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.85 2.47 55.12 Favored Glycine 0 N--CA 1.469 0.89 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.006 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.674 HD12 HD13 ' A' ' 58' ' ' LEU . 67.6 mt -82.15 115.55 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 110.937 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 90.1 mm-40 -79.65 -20.52 46.52 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.665 1.186 . . . . 0.0 111.793 179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.99 108.02 3.26 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 123.517 0.727 . . . . 0.0 109.823 176.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.0 -27.2 50.45 Favored 'Trans proline' 0 C--N 1.385 2.46 0 C-N-CA 122.603 2.202 . . . . 0.0 111.137 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -58.05 -51.23 70.54 Favored 'General case' 0 C--N 1.352 0.717 0 C-N-CA 124.12 0.968 . . . . 0.0 111.19 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.51 ' CD2' HD13 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -62.49 -28.9 70.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.112 0.965 . . . . 0.0 110.664 -179.058 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.1 mt -73.2 -54.82 7.49 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.623 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -57.55 -38.09 74.17 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.397 0.679 . . . . 0.0 111.55 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -69.03 -37.04 78.38 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.535 0.734 . . . . 0.0 111.829 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.436 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -62.5 -47.77 82.49 Favored 'General case' 0 C--O 1.241 0.608 0 O-C-N 123.366 0.416 . . . . 0.0 110.868 172.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.1 mm? -64.67 -35.6 81.56 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.563 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -75.43 -36.53 60.77 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.89 -33.82 74.4 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.463 0.705 . . . . 0.0 110.616 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 m -91.1 3.14 55.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.295 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 65.55 12.05 7.91 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.141 1.377 . . . . 0.0 113.099 173.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.4 -11.56 7.16 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 119.518 -0.601 . . . . 0.0 112.624 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -79.64 108.24 13.02 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 117.401 0.601 . . . . 0.0 109.999 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.491 ' O ' HG23 ' A' ' 55' ' ' VAL . 16.2 tt -67.85 -31.34 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.969 -175.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 23.9 m -70.97 -43.39 68.18 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.039 0.536 . . . . 0.0 110.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 20.9 mm-40 -68.04 -32.05 72.14 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.207 175.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.96 93.78 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.386 0.675 . . . . 0.0 110.978 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.0 t -60.81 -46.4 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 123.69 0.619 . . . . 0.0 109.698 174.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.6 m -55.82 -39.18 71.02 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.567 0.747 . . . . 0.0 112.158 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.75 -40.28 63.61 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.326 0.651 . . . . 0.0 111.741 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.674 HD13 HD12 ' A' ' 34' ' ' ILE . 88.6 mt -68.69 -46.29 69.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.528 0.331 . . . . 0.0 111.878 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.6 p -63.84 -25.52 68.21 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 124.096 0.873 . . . . 0.0 111.198 -178.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.71 -64.65 0.81 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.34 171.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 64' ' ' LYS . 37.7 mt-10 -65.8 -25.38 67.21 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -168.047 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.09 -8.53 57.63 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 122.98 0.512 . . . . 0.0 112.008 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.7 18.16 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.469 0 C-N-CA 123.386 0.675 . . . . 0.0 109.743 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.417 ' HB2' ' HA ' ' A' ' 61' ' ' GLU . 47.8 tttp -77.64 93.89 4.3 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.243 0.617 . . . . 0.0 110.973 -173.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -96.51 152.78 38.84 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.515 0.726 . . . . 0.0 110.254 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.48 118.27 5.49 Favored 'Cis proline' 0 C--N 1.385 2.449 0 CA-C-N 120.417 1.185 . . . . 0.0 113.885 3.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.7 t -130.21 110.36 11.51 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.782 1.233 . . . . 0.0 107.881 173.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -105.58 27.67 8.18 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 122.308 1.052 . . . . 0.0 109.047 177.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -84.38 58.17 4.69 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.408 1.083 . . . . 0.0 109.042 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -80.15 139.5 36.78 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.848 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.0 t -98.42 102.32 13.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 -24.19 34.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.387 0.675 . . . . 0.0 111.539 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 t -77.53 156.34 31.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.006 0.523 . . . . 0.0 110.83 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.62 143.12 31.54 Favored Pre-proline 0 CA--C 1.554 1.11 0 C-N-CA 124.063 0.945 . . . . 0.0 110.624 -177.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.76 117.23 3.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 123.324 2.683 . . . . 0.0 111.668 168.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.8 p -105.37 6.51 32.68 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.694 0.797 . . . . 0.0 111.256 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -75.49 82.83 2.55 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.249 1.02 . . . . 0.0 110.153 -171.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.4 m -110.98 154.15 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.498 1.119 . . . . 0.0 109.339 176.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -75.38 -49.35 19.29 Favored 'General case' 0 C--O 1.243 0.713 0 C-N-CA 123.15 0.58 . . . . 0.0 110.375 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 132.1 -36.47 2.2 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.412 -176.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.9 m -104.04 173.79 6.15 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.473 0.709 . . . . 0.0 110.862 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.24 63.72 7.32 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.444 1.097 . . . . 0.0 109.675 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -99.86 -145.48 0.33 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.294 1.038 . . . . 0.0 109.833 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -73.86 70.02 1.42 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.436 1.112 . . . . 0.0 110.844 174.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -100.3 137.92 38.07 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.88 1.272 . . . . 0.0 108.457 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -64.25 108.96 1.72 Allowed 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 169.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.0 m -64.57 142.51 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 112.304 -169.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 tt -97.16 81.26 3.02 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.82 43.56 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.658 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.422 ' HE3' ' N ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -64.18 147.93 51.18 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.422 0.63 . . . . 0.0 110.495 176.481 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 16.1 m -123.99 38.38 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.481 1.112 . . . . 0.0 108.419 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 42.8 mm 61.18 83.81 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.912 0 C-N-CA 125.18 1.392 . . . . 0.0 109.123 -168.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -139.91 139.85 36.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.632 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.31 -29.7 2.96 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.607 0.763 . . . . 0.0 109.651 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 t -60.62 133.2 55.86 Favored 'General case' 0 C--N 1.354 0.776 0 CA-C-O 121.716 0.769 . . . . 0.0 111.707 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -100.82 12.08 38.28 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.047 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.55 -29.94 71.13 Favored 'General case' 0 C--N 1.362 1.121 0 C-N-CA 124.044 0.938 . . . . 0.0 110.705 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -55.71 147.21 19.12 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.574 0.75 . . . . 0.0 110.138 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.656 ' HD3' ' HB2' ' A' ' 101' ' ' ASP . 0.1 OUTLIER -64.42 151.88 42.99 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 121.033 0.444 . . . . 0.0 109.919 172.72 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -91.27 -9.25 45.8 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.527 0.731 . . . . 0.0 110.291 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.656 ' HB2' ' HD3' ' A' ' 99' ' ' LYS . 7.5 m-20 -59.43 -47.86 83.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.648 0.779 . . . . 0.0 112.259 -173.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.583 HD12 ' HG3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -68.54 -33.18 73.65 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.231 0.332 . . . . 0.0 110.337 179.097 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.401 ' H ' HD13 ' A' ' 102' ' ' LEU . 15.2 mm100 -72.16 -29.54 64.13 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.642 0.777 . . . . 0.0 111.284 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.15 -44.83 59.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.799 0.84 . . . . 0.0 109.474 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.89 73.19 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.609 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.8 mm -71.04 -40.35 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.457 0.703 . . . . 0.0 111.193 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -60.7 -42.01 96.35 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.387 0.429 . . . . 0.0 110.617 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.36 -50.48 67.54 Favored 'General case' 0 C--N 1.353 0.745 0 O-C-N 123.815 0.697 . . . . 0.0 109.71 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -63.8 -29.85 71.0 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.556 0.742 . . . . 0.0 111.211 -178.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.42 -42.61 71.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.934 0.894 . . . . 0.0 110.561 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 74.7 mt -74.17 -26.82 60.51 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.122 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -93.05 1.63 57.16 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.502 0.721 . . . . 0.0 110.918 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.2 m -57.77 142.19 78.79 Favored Pre-proline 0 C--N 1.359 0.992 0 C-N-CA 123.081 0.552 . . . . 0.0 110.509 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.45 151.08 82.09 Favored 'Trans proline' 0 C--N 1.38 2.2 0 C-N-CA 122.79 2.326 . . . . 0.0 112.288 -173.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -5.69 5.47 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.07 0.948 . . . . 0.0 112.606 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 22.5 mt -59.71 -23.19 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.879 1.272 . . . . 0.0 111.834 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -60.31 -27.74 67.56 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.335 1.054 . . . . 0.0 111.846 175.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -121.86 -72.2 0.7 Allowed 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.755 0.822 . . . . 0.0 110.166 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -132.73 79.94 1.87 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.904 0.882 . . . . 0.0 110.616 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -156.82 8.49 0.24 Allowed Glycine 0 CA--C 1.535 1.287 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.631 171.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -51.66 97.05 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.036 1.334 . . . . 0.0 111.249 172.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -79.69 -50.12 11.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.772 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 5.2 mp -83.19 83.74 7.74 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.236 0.614 . . . . 0.0 109.864 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -86.56 -40.29 15.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 172.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.71 132.62 56.36 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 163.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' MET . . . . . 0.447 ' SD ' ' N ' ' A' ' 126' ' ' MET . 2.8 mpp? -97.75 -67.4 0.85 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 59.1 m80 -147.82 138.43 23.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.387 1.075 . . . . 0.0 109.572 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 110.2 11.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 173.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.64 -67.16 0.58 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.517 0.727 . . . . 0.0 111.227 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 1.4 p -159.17 107.76 1.85 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.188 1.395 . . . . 0.0 108.147 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.2 t -67.4 -20.46 65.54 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.361 0.665 . . . . 0.0 112.269 -176.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.248 0 C-N-CA 123.577 0.751 . . . . 0.0 109.169 176.349 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.377 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.5 ttt -49.02 -46.81 44.64 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.912 0.885 . . . . 0.0 113.359 -168.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.453 ' H ' HD23 ' A' ' 24' ' ' LEU . 1.8 pt? -51.83 -44.95 63.78 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.685 0.794 . . . . 0.0 111.85 175.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.43 -38.63 81.37 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.019 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.37 -53.72 44.25 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 123.634 0.584 . . . . 0.0 110.376 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -50.04 -56.46 10.67 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 124.516 1.135 . . . . 0.0 109.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.4 tp -57.7 -50.16 74.12 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 124.799 1.312 . . . . 0.0 111.166 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -57.26 -39.24 75.2 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.655 1.182 . . . . 0.0 112.489 -175.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.43 -37.02 52.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.303 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 pt -90.11 -14.11 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 80.2 p -102.96 -31.18 10.36 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.288 0.635 . . . . 0.0 110.409 173.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.11 -7.43 76.17 Favored Glycine 0 N--CA 1.47 0.917 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.963 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.514 HD12 HD13 ' A' ' 58' ' ' LEU . 84.6 mt -80.04 117.35 25.72 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 C-N-CA 124.004 0.921 . . . . 0.0 110.993 -173.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -82.35 -25.82 33.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.749 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 6.7 m-20 -58.92 109.35 1.81 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 124.081 0.952 . . . . 0.0 111.13 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.84 -23.13 48.22 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.113 2.542 . . . . 0.0 111.977 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.2 m -56.91 -52.13 66.39 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.971 0.908 . . . . 0.0 109.933 174.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.35 -38.51 91.45 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.784 0.834 . . . . 0.0 110.897 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.594 ' HA ' HD23 ' A' ' 28' ' ' LEU . 73.8 mt -69.63 -55.49 9.9 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.261 0.976 . . . . 0.0 111.437 -173.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -63.96 -42.41 97.29 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.252 0.621 . . . . 0.0 111.769 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 45.2 mt-10 -72.52 -29.41 63.57 Favored 'General case' 0 C--N 1.351 0.647 0 C-N-CA 122.876 0.47 . . . . 0.0 111.881 -176.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.15 74.7 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 117.838 0.29 . . . . 0.0 110.407 172.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.463 ' CD2' HD22 ' A' ' 28' ' ' LEU . 3.0 mm? -67.79 -32.72 73.48 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.794 0.838 . . . . 0.0 110.891 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.2 tmmm? -71.53 -44.9 63.77 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.921 0.888 . . . . 0.0 110.238 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.57 -30.47 67.18 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.729 0.812 . . . . 0.0 111.447 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.3 p -85.68 0.48 52.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.448 0.699 . . . . 0.0 112.135 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 64.5 25.75 13.3 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 122.08 0.943 . . . . 0.0 110.491 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.1 65.12 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.456 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -74.58 108.51 7.38 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.552 ' O ' HG23 ' A' ' 55' ' ' VAL . 7.0 tp -55.73 -44.68 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.478 0.486 . . . . 0.0 111.784 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.5 m -66.28 -39.37 89.35 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.842 0.857 . . . . 0.0 111.329 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.492 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 mm-40 -62.9 -43.32 99.12 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 122.976 0.51 . . . . 0.0 110.029 173.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.57 -41.08 93.88 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 124.082 0.864 . . . . 0.0 111.614 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -58.86 -49.86 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.299 173.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.1 t -61.75 -31.29 71.46 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.077 0.861 . . . . 0.0 111.788 -178.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.8 mt -73.24 -33.93 65.59 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.514 HD13 HD12 ' A' ' 34' ' ' ILE . 80.2 mt -89.3 -17.54 28.75 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.4 p -96.91 -14.91 21.46 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.046 0.384 . . . . 0.0 111.867 -178.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -76.87 -20.38 56.35 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 171.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.49 -47.26 84.73 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 124.588 1.155 . . . . 0.0 111.666 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -72.08 -14.81 61.95 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.143 0.577 . . . . 0.0 112.383 -174.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 p -116.04 3.31 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.848 0.859 . . . . 0.0 109.961 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -72.08 97.8 1.98 Allowed 'General case' 0 C--N 1.348 0.533 0 C-N-CA 123.515 0.726 . . . . 0.0 110.118 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.08 138.19 73.04 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.95 0.9 . . . . 0.0 112.611 -175.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -83.71 115.26 3.52 Favored 'Cis proline' 0 C--N 1.378 2.086 0 C-N-CA 124.311 -1.121 . . . . 0.0 112.931 -3.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 67.8 m -100.14 57.63 0.97 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 173.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -73.73 103.15 4.19 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -75.82 74.31 2.76 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.379 1.072 . . . . 0.0 110.118 -174.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 42.5 p -86.08 109.12 18.61 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.861 0.864 . . . . 0.0 109.95 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 5.9 p -130.7 96.03 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-O 122.151 0.977 . . . . 0.0 110.908 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.71 -4.37 53.29 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.984 167.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.8 m -71.3 114.04 8.96 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.74 130.68 85.1 Favored Pre-proline 0 CA--C 1.557 1.224 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 170.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.99 110.5 1.16 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 122.956 2.437 . . . . 0.0 111.772 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.9 p -72.68 77.6 1.1 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.154 0.982 . . . . 0.0 110.859 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -88.21 -41.22 13.1 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.491 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 44.1 t 74.45 -20.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 C-N-CA 125.508 1.523 . . . . 0.0 112.366 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.69 101.11 0.76 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.117 0.967 . . . . 0.0 111.318 -172.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -82.45 -59.78 2.2 Favored Glycine 0 C--N 1.345 1.035 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 174.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 46.9 m 54.1 36.03 23.74 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.826 1.25 . . . . 0.0 111.806 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.3 55.92 3.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.598 0.759 . . . . 0.0 109.624 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.71 83.66 7.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.28 -176.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -97.78 -13.34 21.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.424 175.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -66.8 104.75 1.4 Allowed 'General case' 0 C--N 1.357 0.904 0 C-N-CA 123.175 0.59 . . . . 0.0 109.725 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.63 157.62 43.41 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 123.557 0.743 . . . . 0.0 109.365 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 30.9 m -83.51 122.03 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.5 mt -88.25 63.62 7.26 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 122.053 0.93 . . . . 0.0 108.713 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.47 -174.18 2.41 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.432 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -142.17 141.15 32.58 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.5 p -107.12 18.34 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 122.434 1.112 . . . . 0.0 110.008 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 29.6 mm -98.94 8.45 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.282 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -85.78 57.66 4.6 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.935 0.894 . . . . 0.0 110.756 -179.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -60.42 -28.31 68.16 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.572 1.149 . . . . 0.0 112.164 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.1 p -64.71 -24.39 67.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.404 1.082 . . . . 0.0 113.187 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -143.55 30.41 1.36 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.039 0.535 . . . . 0.0 110.457 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.1 -47.33 77.59 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.878 0.471 . . . . 0.0 110.542 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -112.35 165.62 12.03 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.971 0.909 . . . . 0.0 109.856 173.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -138.52 154.27 48.77 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.881 0.872 . . . . 0.0 108.793 174.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -86.31 16.95 4.0 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.685 0.794 . . . . 0.0 112.251 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -67.45 -66.48 0.55 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.533 0.733 . . . . 0.0 110.832 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.435 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -59.9 -30.8 69.27 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.181 176.836 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -67.85 -45.17 75.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.135 0.974 . . . . 0.0 110.852 -176.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.45 -27.02 61.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.564 0.746 . . . . 0.0 110.903 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.03 81.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.434 0.694 . . . . 0.0 111.233 174.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' ' 102' ' ' LEU . 42.5 mm -64.53 -42.06 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.953 0.901 . . . . 0.0 109.793 175.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.74 91.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.935 0.894 . . . . 0.0 111.383 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.08 -44.56 84.11 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.7 0.8 . . . . 0.0 109.378 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t -66.49 -36.44 82.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.516 0.726 . . . . 0.0 112.193 -175.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 48.9 mt -97.44 -26.18 14.94 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -171.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 64.4 tp -88.67 -31.34 18.56 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.034 0.534 . . . . 0.0 110.497 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 74.41 163.77 0.27 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 127.324 2.249 . . . . 0.0 111.334 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.1 m -94.98 119.0 66.55 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 123.4 0.68 . . . . 0.0 109.546 175.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 112.11 2.18 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.124 1.883 . . . . 0.0 110.112 172.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.583 ' H ' ' HD3' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -86.97 50.94 2.11 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.089 0.947 . . . . 0.0 111.312 -171.855 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.476 HG23 ' HA3' ' A' ' 120' ' ' GLY . 47.4 mt -88.45 73.54 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -82.49 -49.48 9.88 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.804 -1.544 . . . . 0.0 109.545 -171.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -140.81 106.17 5.05 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 114.631 -1.168 . . . . 0.0 107.98 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.409 ' HA ' ' HB2' ' A' ' 123' ' ' LEU . 30.8 t70 75.24 -61.04 0.49 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.256 1.422 . . . . 0.0 112.068 -174.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLY . . . . . 0.476 ' HA3' HG23 ' A' ' 116' ' ' ILE . . . 55.21 -98.98 0.06 OUTLIER Glycine 0 C--N 1.355 1.616 0 O-C-N 123.68 0.612 . . . . 0.0 113.582 -175.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.64 23.17 0.28 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.669 0.788 . . . . 0.0 110.411 177.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -146.46 16.91 1.32 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.104 0.478 . . . . 0.0 111.586 -171.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 119' ' ' ASP . 0.2 OUTLIER -81.15 -6.25 58.62 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.912 0.485 . . . . 0.0 110.662 175.166 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -60.78 155.39 19.47 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.233 0.613 . . . . 0.0 109.915 169.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.07 6.23 1.07 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 125.705 1.602 . . . . 0.0 110.872 -178.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.8 ttt -82.73 109.91 17.31 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -100.58 139.62 36.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.119 0.567 . . . . 0.0 110.236 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -60.71 -48.12 83.21 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 51.78 73.7 0.3 Allowed 'General case' 0 C--N 1.351 0.668 0 O-C-N 125.092 1.495 . . . . 0.0 112.038 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 45.3 p -72.38 123.22 22.61 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.53 -178.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.6 m -73.91 -49.67 23.72 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.704 0.801 . . . . 0.0 110.008 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.403 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.722 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -61.52 -48.21 82.08 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.431 0.292 . . . . 0.0 111.081 -175.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.614 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -61.54 -40.93 96.44 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.345 1.058 . . . . 0.0 112.134 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.614 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -64.5 -51.38 63.25 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.929 0.892 . . . . 0.0 110.799 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -69.34 -44.09 72.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.294 1.038 . . . . 0.0 111.456 -172.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -64.64 -46.79 81.03 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.755 0.66 . . . . 0.0 110.949 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -61.39 -46.04 91.85 Favored 'General case' 0 C--N 1.363 1.188 0 O-C-N 123.552 0.533 . . . . 0.0 110.532 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -58.34 -36.95 74.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.782 0.833 . . . . 0.0 111.634 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.86 -45.54 64.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.015 0.526 . . . . 0.0 111.052 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.3 pt -83.22 -19.84 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.499 HG21 HD12 ' A' ' 58' ' ' LEU . 81.4 p -98.91 -40.73 7.94 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.267 0.627 . . . . 0.0 110.142 176.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.49 -3.23 57.74 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.131 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.713 HD12 HD13 ' A' ' 58' ' ' LEU . 61.6 mt -77.74 113.99 17.66 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 C-N-CA 123.588 0.755 . . . . 0.0 111.012 -172.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -81.26 -15.72 54.73 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.706 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.25 114.13 37.43 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.434 ' HG2' HD23 ' A' ' 94' ' ' LEU . 74.4 Cg_endo -71.91 -15.86 29.45 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.776 2.317 . . . . 0.0 113.221 -176.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -67.17 -51.02 58.81 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -55.63 -34.74 65.18 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 124.031 0.832 . . . . 0.0 111.881 176.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.2 mt -68.35 -53.81 21.53 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 123.911 0.757 . . . . 0.0 110.428 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -58.8 -38.26 78.19 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.757 175.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' HG2' HD13 ' A' ' 92' ' ' ILE . 41.8 mt-10 -74.97 -29.29 60.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.027 0.531 . . . . 0.0 111.806 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.3 77.43 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -76.42 -23.32 53.98 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.929 0.892 . . . . 0.0 110.073 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -70.45 -56.36 6.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.899 1.28 . . . . 0.0 110.44 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.71 69.36 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.974 0.91 . . . . 0.0 111.061 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.506 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 89.4 p -84.43 -5.75 59.31 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.516 0.726 . . . . 0.0 112.052 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 70.1 13.32 7.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.1 1.36 . . . . 0.0 112.025 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.08 42.84 1.59 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -132.4 115.52 15.68 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.501 0.72 . . . . 0.0 109.352 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.3 tt -74.13 -21.1 17.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.327 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 83.7 m -73.06 -49.81 26.51 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.221 0.608 . . . . 0.0 110.435 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 29.0 mm-40 -60.19 -40.38 89.82 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.785 172.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.82 -52.99 63.38 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.238 0.961 . . . . 0.0 112.263 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.452 HG23 HG22 ' A' ' 32' ' ' THR . 10.1 p -64.48 -36.0 76.04 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 C-N-CA 122.6 0.36 . . . . 0.0 110.446 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.7 t -63.03 -40.97 99.32 Favored 'General case' 0 CA--C 1.554 1.135 0 O-C-N 123.751 0.657 . . . . 0.0 111.27 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.56 -22.58 54.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.668 0.787 . . . . 0.0 111.648 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 HD12 ' A' ' 34' ' ' ILE . 82.5 mt -85.66 -29.21 24.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.529 0.331 . . . . 0.0 111.545 173.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.0 p -83.88 11.58 7.44 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.5 0.32 . . . . 0.0 111.019 174.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 64' ' ' LYS . 16.4 t70 -50.49 -41.3 53.09 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 123.815 0.846 . . . . 0.0 110.335 166.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -49.32 -34.87 16.75 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.758 1.223 . . . . 0.0 113.503 -177.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -99.15 -29.33 12.92 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.5 p -99.92 -0.25 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 122.852 0.461 . . . . 0.0 111.557 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 24.9 tttp -73.79 91.25 1.92 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 -178.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.17 144.7 90.97 Favored Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 123.798 0.839 . . . . 0.0 112.003 -176.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.61 106.26 0.86 Allowed 'Cis proline' 0 C--N 1.382 2.313 0 CA-C-N 119.546 0.873 . . . . 0.0 112.767 0.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 67.9 m -137.93 100.92 4.3 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 172.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -79.75 92.38 5.42 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 123.341 0.657 . . . . 0.0 110.104 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -150.22 130.87 14.01 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.051 0.94 . . . . 0.0 108.697 176.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.9 p -76.79 82.3 3.38 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 121.577 0.703 . . . . 0.0 109.429 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.85 137.22 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.516 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.06 69.98 8.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.748 0.785 . . . . 0.0 109.706 177.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.6 m -158.57 120.96 3.64 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 125.656 1.582 . . . . 0.0 107.449 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -75.98 150.35 83.42 Favored Pre-proline 0 CA--C 1.551 0.995 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.37 103.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.376 2.0 0 C-N-CA 123.224 2.616 . . . . 0.0 111.279 168.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 p -67.72 163.98 20.4 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.011 0.925 . . . . 0.0 111.358 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -116.32 -18.92 10.37 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.201 0.6 . . . . 0.0 112.405 -167.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 10.6 t -105.71 48.66 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 CA-C-O 121.864 0.84 . . . . 0.0 111.089 -165.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -87.35 70.96 10.01 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.758 0.79 . . . . 0.0 109.66 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.05 -8.55 60.23 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.878 165.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 m -81.26 79.75 7.83 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.637 1.175 . . . . 0.0 109.925 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -52.46 9.92 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.073 178.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 63.13 30.78 16.04 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.598 1.159 . . . . 0.0 111.38 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -73.09 88.45 1.43 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.539 0.736 . . . . 0.0 109.205 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -150.15 86.69 1.43 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.804 -173.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -76.26 90.67 3.17 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.477 0.711 . . . . 0.0 109.891 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.68 144.35 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.969 0.908 . . . . 0.0 110.028 178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.0 tp -103.39 38.44 1.78 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 122.134 0.968 . . . . 0.0 108.775 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.36 139.11 11.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.79 1.236 . . . . 0.0 108.126 -176.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 161.16 43.2 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.068 0.461 . . . . 0.0 111.202 -171.705 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 20.1 t -109.1 43.02 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 124.401 1.08 . . . . 0.0 108.416 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.46 HD13 ' HG2' ' A' ' 42' ' ' GLU . 8.2 mt -106.75 49.85 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -88.52 83.08 6.82 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.434 HD23 ' HG2' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -113.53 -3.56 13.65 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.363 -176.374 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 t -60.93 148.95 38.01 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.767 0.827 . . . . 0.0 111.906 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -153.63 92.25 1.56 Allowed 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.68 95.56 0.5 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.306 1.042 . . . . 0.0 111.591 -172.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -89.49 105.51 17.84 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 170.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -68.9 138.24 54.5 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -80.24 26.18 0.37 Allowed 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.119 0.968 . . . . 0.0 113.104 -171.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.32 -66.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.55 1.14 . . . . 0.0 110.513 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -23.58 61.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.503 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -63.19 -49.24 75.03 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 172.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.75 -38.09 85.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.652 0.595 . . . . 0.0 111.414 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.64 -49.37 68.91 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.79 0.836 . . . . 0.0 111.436 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.4 mm -67.48 -43.41 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.309 0.643 . . . . 0.0 110.467 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.417 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -57.83 -49.37 76.9 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 123.949 0.781 . . . . 0.0 111.143 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.38 -43.47 90.62 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.033 0.933 . . . . 0.0 109.604 -178.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.8 t -76.68 -14.08 59.99 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.115 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.11 -42.22 23.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 172.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 87.7 mt -66.55 -37.98 86.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.555 177.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 55.69 49.98 15.25 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.055 . . . . 0.0 111.178 -174.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 27.5 p -110.44 87.99 7.0 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.782 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' PRO . . . . . 0.513 ' HB2' HG13 ' A' ' 116' ' ' ILE . 75.5 Cg_endo -82.01 147.55 14.93 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.587 2.191 . . . . 0.0 111.973 177.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.573 ' HE3' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -89.18 49.29 1.74 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 123.667 0.787 . . . . 0.0 110.025 -178.012 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.516 HG12 ' H ' ' A' ' 121' ' ' ARG . 24.6 mt -82.14 64.91 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 122.404 1.097 . . . . 0.0 108.84 178.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -149.91 -13.05 0.27 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 109.379 -176.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -150.06 -59.53 0.2 Allowed 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.261 0.624 . . . . 0.0 110.866 -167.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -157.14 28.83 0.3 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.889 0.476 . . . . 0.0 112.068 -173.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -81.84 -96.84 0.46 Allowed Glycine 0 C--N 1.344 1.001 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.516 ' H ' HG12 ' A' ' 116' ' ' ILE . 7.5 mpt_? -126.56 27.73 6.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.748 0.819 . . . . 0.0 109.282 175.217 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.32 76.62 8.25 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-O 121.747 0.784 . . . . 0.0 110.481 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 37.3 tp -96.96 71.86 2.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.0 0.92 . . . . 0.0 108.737 175.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -81.42 137.54 35.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.59 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -99.81 42.98 1.08 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 172.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 54.0 ttp -65.56 122.13 16.52 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.157 0.983 . . . . 0.0 110.35 -178.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 48.9 m80 -123.54 103.8 8.66 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -78.55 165.31 23.86 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.247 1.019 . . . . 0.0 110.587 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.02 90.52 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.735 0.814 . . . . 0.0 110.544 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 22.3 m -90.3 -66.18 0.95 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.769 0.827 . . . . 0.0 110.599 -172.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.4 t -102.07 -5.88 24.01 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.081 0.553 . . . . 0.0 110.785 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.955 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.896 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.414 ' HG3' ' HB2' ' A' ' 25' ' ' LEU . 4.0 tp-100 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.8 tpp -52.72 -58.41 6.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.45 1.1 . . . . 0.0 113.235 -164.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.664 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.8 pt? -59.3 -36.88 76.4 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.772 0.829 . . . . 0.0 112.718 -177.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.664 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -66.55 -46.93 74.47 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.123 0.569 . . . . 0.0 110.333 177.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -65.75 -42.55 90.78 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.251 0.97 . . . . 0.0 110.882 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -64.51 -52.58 57.07 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 124.328 1.018 . . . . 0.0 111.001 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 40' ' ' LEU . 22.2 tp -57.41 -46.97 82.92 Favored 'General case' 0 C--N 1.364 1.227 0 O-C-N 124.065 0.853 . . . . 0.0 110.264 178.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -53.96 -39.72 66.21 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.573 1.149 . . . . 0.0 111.769 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -72.55 -40.43 66.68 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.635 -176.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.0 pt -98.88 2.17 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 123.672 0.789 . . . . 0.0 112.584 -172.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.1 p -112.57 -42.49 3.64 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.307 0.643 . . . . 0.0 109.454 168.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.57 -13.87 38.97 Favored Glycine 0 N--CA 1.468 0.781 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.613 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.519 HD12 HD13 ' A' ' 58' ' ' LEU . 72.0 mt -75.16 110.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.35 0.602 0 C-N-CA 123.912 0.885 . . . . 0.0 110.332 -175.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -71.44 -32.73 68.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.057 0.943 . . . . 0.0 111.17 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -64.11 115.53 20.15 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 123.653 0.781 . . . . 0.0 111.53 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.474 ' HA ' HD12 ' A' ' 40' ' ' LEU . 42.2 Cg_endo -62.59 -22.62 74.19 Favored 'Trans proline' 0 C--N 1.391 2.812 0 C-N-CA 123.579 2.853 . . . . 0.0 112.97 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -54.43 -53.68 50.96 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.884 0.874 . . . . 0.0 110.976 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.89 -33.53 75.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.677 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.609 ' HA ' HD23 ' A' ' 28' ' ' LEU . 46.2 mt -72.28 -47.1 52.67 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 124.428 1.08 . . . . 0.0 111.038 -171.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -60.94 -54.42 45.28 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.709 0.63 . . . . 0.0 109.901 172.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.83 -30.15 68.75 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.876 0.735 . . . . 0.0 112.391 -174.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.34 -49.83 45.29 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 122.971 0.509 . . . . 0.0 110.317 174.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.505 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.4 mm? -59.04 -29.74 67.51 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.996 0.918 . . . . 0.0 111.246 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -71.65 -51.0 25.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.401 0.68 . . . . 0.0 109.794 174.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.73 62.59 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.713 0.805 . . . . 0.0 112.434 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -104.4 4.27 33.18 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.551 0.74 . . . . 0.0 112.374 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.6 t30 70.66 -2.63 2.18 Favored 'General case' 0 CA--C 1.571 1.751 0 C-N-CA 124.579 1.152 . . . . 0.0 111.582 -176.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.18 -6.95 10.79 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.777 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -79.28 105.95 10.97 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.006 0.523 . . . . 0.0 110.201 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.473 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.2 tt -65.24 -27.21 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 C-N-CA 122.914 0.485 . . . . 0.0 112.167 -173.473 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 36.3 m -66.01 -47.39 74.63 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 123.496 0.719 . . . . 0.0 110.685 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.425 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 21.1 mm-40 -60.9 -39.26 88.67 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.604 174.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.34 -41.54 89.42 Favored 'General case' 0 C--O 1.246 0.869 0 O-C-N 124.051 0.845 . . . . 0.0 111.856 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.3 t -59.18 -50.09 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 123.723 0.64 . . . . 0.0 109.71 173.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m -56.7 -41.74 77.91 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 124.307 1.004 . . . . 0.0 111.482 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -74.1 -29.85 62.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.684 0.794 . . . . 0.0 111.898 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.519 HD13 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -84.17 -32.53 24.55 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 177.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.7 p -79.84 -18.78 49.97 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -76.15 -4.25 40.58 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -175.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.21 -37.44 74.82 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.387 0.675 . . . . 0.0 111.326 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -77.63 -11.54 59.88 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.794 0.837 . . . . 0.0 111.889 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.55 -26.3 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.243 0.617 . . . . 0.0 109.682 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.85 102.77 5.64 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 177.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.525 ' HA ' ' H ' ' A' ' 67' ' ' SER . 13.7 pt-20 -67.66 153.54 94.87 Favored Pre-proline 0 CA--C 1.566 1.581 0 C-N-CA 123.854 0.862 . . . . 0.0 110.982 175.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -84.69 93.68 0.14 OUTLIER 'Cis proline' 0 C--N 1.387 2.581 0 CA-C-N 120.474 1.205 . . . . 0.0 113.302 2.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.525 ' H ' ' HA ' ' A' ' 65' ' ' GLU . 12.0 p -94.91 -74.0 0.56 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.997 0.919 . . . . 0.0 109.851 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 179.4 145.61 0.18 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.866 1.267 . . . . 0.0 108.691 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.63 38.39 0.69 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.663 0.785 . . . . 0.0 111.279 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.7 t -79.31 -178.55 6.28 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.002 0.921 . . . . 0.0 110.835 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.7 m -52.52 117.95 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 C-N-CA 124.56 1.144 . . . . 0.0 112.183 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.03 95.16 2.8 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.953 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.0 t -94.52 176.04 6.44 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.261 0.624 . . . . 0.0 109.729 177.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -69.18 138.8 89.68 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 123.463 0.705 . . . . 0.0 111.496 -172.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.65 174.75 12.11 Favored 'Trans proline' 0 C--N 1.382 2.333 0 C-N-CA 123.081 2.521 . . . . 0.0 111.535 173.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.1 m 59.14 29.27 18.79 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.117 0.967 . . . . 0.0 110.827 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.05 -45.29 89.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.072 0.949 . . . . 0.0 110.393 -177.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -70.35 143.62 14.48 Favored 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.024 178.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.48 98.64 1.87 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.589 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.22 -30.58 64.85 Favored Glycine 0 C--N 1.346 1.088 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.44 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 29.7 t 58.69 25.1 12.93 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.26 1.024 . . . . 0.0 110.891 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -115.71 77.83 1.12 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.76 1.224 . . . . 0.0 108.204 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -73.13 80.99 1.27 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.349 0.66 . . . . 0.0 109.786 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -76.56 95.96 4.02 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -93.88 32.86 1.38 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.553 0.741 . . . . 0.0 110.152 178.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.21 100.41 1.68 Allowed 'General case' 0 C--N 1.348 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.565 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.0 t -65.24 122.18 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 124.197 0.936 . . . . 0.0 109.554 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -84.52 -24.72 29.22 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.012 0.525 . . . . 0.0 110.403 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.78 108.53 12.28 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.232 0.613 . . . . 0.0 111.191 -177.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.541 ' HG2' ' H ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -145.14 170.44 16.22 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.515 1.126 . . . . 0.0 108.252 172.58 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -114.4 27.16 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 CA-C-O 122.585 1.183 . . . . 0.0 109.075 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.541 ' H ' ' HG2' ' A' ' 90' ' ' LYS . 47.5 mt -110.46 78.22 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.511 -176.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -162.34 87.71 0.63 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.375 -1.284 . . . . 0.0 107.566 166.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.426 ' H ' HD23 ' A' ' 94' ' ' LEU . 2.1 pt? -101.21 -30.83 11.32 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.913 -177.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 t -103.81 124.32 48.7 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 121.838 0.828 . . . . 0.0 111.823 -174.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -168.66 38.66 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.62 1.568 . . . . 0.0 106.942 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.07 -49.02 14.77 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.531 -168.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -70.41 110.69 5.47 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 123.982 0.802 . . . . 0.0 109.51 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.417 ' HD2' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -81.56 145.66 30.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.101 -178.041 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -87.67 -1.32 57.88 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.378 0.671 . . . . 0.0 110.606 -178.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.6 -51.04 64.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.492 1.117 . . . . 0.0 111.726 -179.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.417 HD12 ' HD2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -76.59 -22.91 53.6 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.179 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -61.1 -55.98 26.2 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 170.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.14 79.75 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.635 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.57 -56.17 8.08 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.398 0.679 . . . . 0.0 111.414 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.7 mm -64.22 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.226 0.61 . . . . 0.0 110.369 -178.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.25 -47.18 80.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.307 0.643 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.9 tp -65.82 -31.57 72.6 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 122.702 0.401 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.3 t -71.62 -33.61 69.11 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.548 0.739 . . . . 0.0 110.864 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 41.6 tp -71.43 -44.6 64.55 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.903 0.881 . . . . 0.0 111.022 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.38 -32.57 68.62 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.002 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 49.61 20.7 0.53 Allowed 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 126.876 2.07 . . . . 0.0 114.156 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.9 p -128.24 120.74 21.28 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.199 1.0 . . . . 0.0 108.306 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.45 75.63 2.92 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.641 2.227 . . . . 0.0 111.366 174.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? 66.51 8.08 5.52 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 125.034 1.334 . . . . 0.0 112.385 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 42.9 mm -80.02 95.74 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -122.49 62.06 0.98 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.651 0.78 . . . . 0.0 109.579 -177.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 75.9 -24.94 0.21 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.868 1.267 . . . . 0.0 113.269 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -85.65 -22.48 27.89 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.835 0.854 . . . . 0.0 112.2 -175.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -82.31 -123.46 0.75 Allowed Glycine 0 C--N 1.354 1.575 0 O-C-N 123.178 0.299 . . . . 0.0 113.359 -173.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -3.96 22.18 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 124.077 0.951 . . . . 0.0 112.998 -179.06 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.71 -21.46 66.53 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 125.045 1.338 . . . . 0.0 111.877 -178.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tt 70.63 100.83 0.06 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 125.159 1.384 . . . . 0.0 108.532 -177.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -154.31 147.75 25.06 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.04 0.936 . . . . 0.0 108.731 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -75.09 83.98 2.31 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -111.66 -29.25 7.79 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.221 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -95.66 92.07 6.42 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -76.06 104.6 6.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.042 0.537 . . . . 0.0 110.24 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.21 105.47 6.25 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.098 0.559 . . . . 0.0 110.603 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 21.4 m -88.31 127.23 35.47 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.226 0.611 . . . . 0.0 109.727 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 30.0 t -82.99 -34.62 26.31 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.067 0.547 . . . . 0.0 110.336 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.261 1.024 . . . . 0.0 109.076 -177.161 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -59.21 -35.54 73.79 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.268 1.027 . . . . 0.0 112.861 -171.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.443 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.3 pt? -64.55 -39.57 94.0 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.481 0.713 . . . . 0.0 111.578 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.95 -48.16 69.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.688 0.795 . . . . 0.0 110.161 175.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -62.09 -49.9 74.08 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.618 1.199 . . . . 0.0 110.978 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.421 ' O ' HG12 ' A' ' 31' ' ' ILE . 50.2 mm-40 -62.45 -56.33 19.2 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.462 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.513 HD22 HD23 ' A' ' 44' ' ' LEU . 20.5 tp -57.56 -45.26 85.37 Favored 'General case' 0 C--N 1.36 1.061 0 O-C-N 123.784 0.677 . . . . 0.0 110.685 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -55.6 -45.28 77.47 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.77 0.828 . . . . 0.0 111.243 176.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.25 -34.96 79.18 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.296 0.638 . . . . 0.0 111.29 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.8 pt -104.8 2.42 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -173.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.1 p -112.33 -50.48 2.9 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.511 0.672 . . . . 0.0 109.668 167.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.49 22.53 10.31 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.927 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.441 HD12 HD13 ' A' ' 58' ' ' LEU . 62.4 mt -101.59 122.76 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.242 0.617 . . . . 0.0 110.28 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -81.59 -26.45 34.91 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.174 0.99 . . . . 0.0 111.91 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.13 112.54 10.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.082 0.553 . . . . 0.0 110.525 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.89 -22.01 49.49 Favored 'Trans proline' 0 C--N 1.385 2.456 0 C-N-CA 122.906 2.404 . . . . 0.0 111.872 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -57.28 -52.25 66.1 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.233 0.958 . . . . 0.0 110.188 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -60.72 -40.84 93.79 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.193 0.933 . . . . 0.0 111.584 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.511 ' HA ' HD23 ' A' ' 28' ' ' LEU . 66.0 mt -68.15 -46.28 71.23 Favored 'General case' 0 C--O 1.246 0.887 0 O-C-N 124.083 0.864 . . . . 0.0 111.488 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -64.96 -51.16 63.31 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.328 176.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -58.0 -33.08 68.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.285 0.634 . . . . 0.0 112.18 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.11 -48.88 61.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 123.747 0.654 . . . . 0.0 110.419 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.513 HD23 HD22 ' A' ' 28' ' ' LEU . 3.3 mm? -61.1 -29.64 69.88 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.903 0.881 . . . . 0.0 111.385 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -76.27 -48.19 21.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.793 0.837 . . . . 0.0 110.704 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.89 -35.3 80.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.784 0.834 . . . . 0.0 111.094 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.0 m -87.77 1.92 52.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.649 0.78 . . . . 0.0 111.571 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 66.44 12.16 8.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.848 1.259 . . . . 0.0 112.6 174.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.57 -11.87 11.15 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-O 119.805 -0.442 . . . . 0.0 112.865 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -77.97 104.88 8.81 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 121.293 0.568 . . . . 0.0 110.483 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.503 ' O ' HG23 ' A' ' 55' ' ' VAL . 18.0 tt -64.04 -26.17 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.014 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.3 m -65.13 -52.77 53.26 Favored 'General case' 0 C--O 1.251 1.179 0 C-N-CA 123.685 0.794 . . . . 0.0 110.908 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.477 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 14.3 mm100 -62.15 -37.93 87.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.815 174.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.72 -44.36 81.53 Favored 'General case' 0 C--O 1.247 0.948 0 O-C-N 124.114 0.884 . . . . 0.0 111.848 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 51' ' ' ILE . 59.6 t -59.31 -50.36 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 122.918 0.487 . . . . 0.0 109.806 172.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m -56.99 -35.75 69.56 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.333 1.021 . . . . 0.0 112.169 -175.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 76.7 mt -72.89 -44.02 61.78 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.939 0.495 . . . . 0.0 110.395 178.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.441 HD13 HD12 ' A' ' 34' ' ' ILE . 58.6 mt -78.03 -10.15 59.47 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.4 p -110.21 6.55 22.72 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.86 0.464 . . . . 0.0 110.825 175.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -78.93 -30.53 44.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.969 0.507 . . . . 0.0 111.152 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.444 ' HA ' ' HE2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -61.77 -20.74 63.91 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -172.008 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -82.55 -18.41 41.5 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.991 0.916 . . . . 0.0 111.95 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.8 p -123.19 3.0 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 123.752 0.821 . . . . 0.0 110.09 -177.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 61' ' ' GLU . 23.8 ttmm -68.1 88.81 0.29 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.445 1.098 . . . . 0.0 110.819 -176.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -126.6 134.86 26.49 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.782 . . . . 0.0 109.23 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -75.62 165.65 85.1 Favored 'Cis proline' 0 C--N 1.377 2.077 0 CA-C-N 119.787 0.96 . . . . 0.0 113.28 3.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -72.78 168.95 17.75 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.759 0.824 . . . . 0.0 110.88 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -137.3 111.35 8.35 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -178.294 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -70.06 105.91 3.05 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.556 0.742 . . . . 0.0 110.41 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.3 p -65.76 152.62 43.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.153 0.981 . . . . 0.0 111.256 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.49 137.52 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.171 0.989 . . . . 0.0 112.232 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.34 54.69 2.37 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.129 0.972 . . . . 0.0 110.928 -179.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -76.44 86.46 3.18 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 122.28 1.038 . . . . 0.0 110.641 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.51 146.03 88.3 Favored Pre-proline 0 CA--C 1.546 0.817 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.829 178.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -58.13 116.76 3.47 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.707 2.272 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.7 p -67.78 -176.51 0.66 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.627 0.771 . . . . 0.0 111.391 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.91 78.37 0.31 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.371 0.669 . . . . 0.0 111.192 -174.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.8 p -91.16 95.89 5.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 122.225 1.012 . . . . 0.0 108.666 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.11 100.01 2.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.282 -174.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -172.5 -68.66 0.04 OUTLIER Glycine 0 C--N 1.341 0.86 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.3 t -82.03 -29.58 31.89 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.75 -24.07 61.71 Favored 'General case' 0 C--N 1.354 0.774 0 C-N-CA 123.352 0.661 . . . . 0.0 110.49 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.58 107.74 7.93 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.756 177.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -91.18 95.0 9.83 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -144.47 105.63 4.21 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.401 0.681 . . . . 0.0 109.307 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -78.22 131.37 37.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.541 0.736 . . . . 0.0 109.565 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 56.7 t -90.37 120.72 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -91.3 80.66 5.53 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -177.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -139.86 120.54 14.28 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.099 -174.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.92 157.31 37.57 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.212 0.605 . . . . 0.0 109.85 174.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.7 t -121.87 34.52 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-O 122.294 1.045 . . . . 0.0 108.227 174.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mt -86.23 77.09 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.41 85.02 3.15 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.563 -1.198 . . . . 0.0 109.232 172.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.84 36.84 3.07 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.115 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.9 p -88.83 -8.07 55.02 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.222 -1.354 . . . . 0.0 110.497 173.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -118.06 97.81 6.0 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.602 0.761 . . . . 0.0 109.673 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -112.46 -30.69 7.06 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.341 0.656 . . . . 0.0 109.752 173.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -96.92 137.17 36.41 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.625 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -100.6 143.9 30.22 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -92.76 5.52 50.85 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.481 1.112 . . . . 0.0 112.181 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.87 -45.64 70.48 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.074 0.55 . . . . 0.0 111.614 -170.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.39 -32.35 68.35 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.463 0.705 . . . . 0.0 110.381 -178.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -66.71 -44.64 81.11 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.97 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.22 -35.17 79.03 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 124.104 0.878 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.39 8.37 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.675 0.79 . . . . 0.0 111.073 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.0 mm -61.6 -46.06 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.112 0.965 . . . . 0.0 110.966 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.32 82.31 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.131 0.895 . . . . 0.0 111.149 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -49.44 77.79 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.746 0.654 . . . . 0.0 109.432 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 45.2 m -59.38 -38.24 79.98 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.964 0.79 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.0 mt -81.72 -18.53 44.05 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.531 0.733 . . . . 0.0 111.812 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 80.1 mt -85.37 -21.26 28.94 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.08 0.552 . . . . 0.0 110.621 172.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -76.21 -13.82 60.16 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.333 0.653 . . . . 0.0 110.713 171.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 116' ' ' ILE . 32.9 m -90.01 104.03 7.7 Favored Pre-proline 0 CA--C 1.556 1.199 0 C-N-CA 124.239 1.016 . . . . 0.0 110.154 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -85.13 84.18 1.41 Allowed 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 123.199 2.599 . . . . 0.0 111.211 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? 69.88 13.22 7.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.515 1.126 . . . . 0.0 111.812 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.447 ' O ' ' HB3' ' A' ' 113' ' ' SER . 10.9 mm -118.17 87.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -57.11 -39.59 75.39 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.509 0.723 . . . . 0.0 112.235 -177.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -178.24 172.28 1.56 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.255 1.422 . . . . 0.0 108.768 177.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.2 t70 70.25 -71.21 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.827 1.251 . . . . 0.0 112.431 173.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 149.84 116.89 0.82 Allowed Glycine 0 C--N 1.345 1.039 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -110.48 -62.46 1.52 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.057 0.543 . . . . 0.0 109.634 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.0 t70 63.52 11.29 5.52 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 125.235 1.414 . . . . 0.0 112.8 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.3 -37.54 66.18 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.947 0.899 . . . . 0.0 109.715 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -67.78 105.4 1.93 Allowed 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.324 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -164.3 109.14 0.98 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.1 mtt -70.13 96.65 1.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.229 0.612 . . . . 0.0 109.393 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -79.6 82.13 5.76 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.542 0.686 . . . . 0.0 110.355 -175.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -24.8 56.53 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.564 174.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.58 118.3 18.27 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.718 0.807 . . . . 0.0 110.144 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 72.0 m -129.19 136.47 50.19 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 124.419 1.088 . . . . 0.0 108.595 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -70.62 112.4 6.84 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.555 0.742 . . . . 0.0 109.661 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.938 0 C-N-CA 123.363 0.665 . . . . 0.0 109.68 178.365 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.5 ttm -56.34 -53.31 58.77 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 124.203 1.001 . . . . 0.0 112.41 -169.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.494 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -51.57 -41.28 61.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.035 0.934 . . . . 0.0 112.605 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.494 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.5 mm? -62.99 -52.36 63.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.679 0.792 . . . . 0.0 109.961 176.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -67.37 -39.97 85.72 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 124.218 0.949 . . . . 0.0 111.723 -172.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.442 ' O ' HG12 ' A' ' 31' ' ' ILE . 18.7 mm100 -65.52 -50.42 65.32 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.488 0.715 . . . . 0.0 110.218 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.586 HD23 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -61.55 -45.09 95.65 Favored 'General case' 0 C--N 1.357 0.919 0 O-C-N 123.878 0.737 . . . . 0.0 110.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -56.77 -37.78 71.55 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.595 1.158 . . . . 0.0 111.746 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.59 -51.08 64.59 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.893 0.877 . . . . 0.0 110.496 177.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 27' ' ' GLN . 5.8 pt -96.48 2.38 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -169.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.462 HG21 HD12 ' A' ' 58' ' ' LEU . 73.1 p -110.55 -37.97 5.32 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 167.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.4 -9.07 58.99 Favored Glycine 0 C--N 1.342 0.913 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.012 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.597 HD12 HD13 ' A' ' 58' ' ' LEU . 64.9 mt -79.58 112.17 17.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.491 0 C-N-CA 123.641 0.776 . . . . 0.0 110.409 -174.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -73.11 -29.21 62.75 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.717 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 20.0 t70 -63.09 115.33 16.76 Favored Pre-proline 0 C--N 1.35 0.611 0 C-N-CA 124.0 0.92 . . . . 0.0 111.094 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.443 ' HA ' HD12 ' A' ' 40' ' ' LEU . 58.2 Cg_endo -67.89 -25.92 38.48 Favored 'Trans proline' 0 C--N 1.381 2.287 0 C-N-CA 122.85 2.367 . . . . 0.0 112.744 -176.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.9 m -63.34 -46.6 85.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.677 0.791 . . . . 0.0 111.38 -175.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -61.07 -34.56 75.09 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.576 0.75 . . . . 0.0 111.511 174.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.586 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.6 mt -70.96 -42.06 70.27 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.856 0.723 . . . . 0.0 110.874 -177.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.416 ' CE1' HD11 ' A' ' 25' ' ' LEU . 49.4 m80 -66.68 -48.08 70.43 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.934 178.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.03 -27.33 65.57 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.233 0.333 . . . . 0.0 111.497 -177.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.09 -37.37 69.58 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.629 0.371 . . . . 0.0 110.441 172.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 HD22 ' A' ' 28' ' ' LEU . 1.8 mm? -73.13 -23.96 60.54 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.727 0.811 . . . . 0.0 109.501 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -74.37 -51.68 14.36 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.804 1.241 . . . . 0.0 110.3 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.13 -16.52 63.67 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.817 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 92.6 p -101.2 -7.19 23.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.303 0.641 . . . . 0.0 111.76 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 64.54 22.62 12.71 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.532 1.133 . . . . 0.0 111.583 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.76 -7.54 31.64 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.933 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.52 112.21 14.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.018 0.527 . . . . 0.0 109.718 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.576 ' O ' HG23 ' A' ' 55' ' ' VAL . 9.3 tp -59.72 -42.08 87.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.997 -175.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.8 m -64.02 -46.43 84.52 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 124.07 0.948 . . . . 0.0 111.206 -173.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -63.14 -42.98 99.58 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.767 176.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.35 -42.62 82.37 Favored 'General case' 0 C--O 1.247 0.949 0 O-C-N 123.906 0.754 . . . . 0.0 111.512 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 51' ' ' ILE . 47.0 t -60.17 -49.35 84.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.308 0.643 . . . . 0.0 109.773 175.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.4 t -62.59 -35.47 79.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.857 0.723 . . . . 0.0 112.025 -177.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.59 -27.0 55.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.565 0.746 . . . . 0.0 111.539 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.597 HD13 HD12 ' A' ' 34' ' ' ILE . 72.1 mt -86.85 -38.94 16.32 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 173.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.438 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 77.5 p -76.62 -2.33 32.07 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.292 0.637 . . . . 0.0 110.896 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -51.94 -33.87 39.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.028 1.331 . . . . 0.0 111.393 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -54.54 -36.72 64.58 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.793 1.237 . . . . 0.0 113.533 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 59' ' ' THR . 12.2 ptt180 -75.25 -23.63 57.52 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.602 0.761 . . . . 0.0 110.391 -174.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.3 t -96.14 -28.76 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.702 0.801 . . . . 0.0 110.022 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -72.64 92.95 1.57 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.919 0.888 . . . . 0.0 110.874 -166.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.401 ' HA ' ' N ' ' A' ' 67' ' ' SER . 65.7 mm-40 -63.06 146.22 95.97 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 124.063 0.945 . . . . 0.0 112.606 -175.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.64 105.43 0.72 Allowed 'Cis proline' 0 C--N 1.38 2.223 0 C-N-CA 124.358 -1.101 . . . . 0.0 112.42 -2.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.401 ' N ' ' HA ' ' A' ' 65' ' ' GLU . 45.0 m -80.59 148.59 30.24 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.845 0.458 . . . . 0.0 110.594 177.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -78.82 111.56 15.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.82 116.46 5.27 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.52 0.676 . . . . 0.0 110.202 177.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.6 p -86.16 -170.99 3.35 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.085 0.954 . . . . 0.0 111.188 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.446 HG22 ' H ' ' A' ' 73' ' ' THR . 8.3 p -64.37 129.69 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.284 0 C-N-CA 122.635 0.374 . . . . 0.0 110.522 176.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.58 3.83 45.55 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.419 0.687 . . . . 0.0 111.713 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.446 ' H ' HG22 ' A' ' 71' ' ' VAL . 54.4 m -64.59 129.66 40.67 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.432 0.693 . . . . 0.0 111.384 178.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.55 145.46 98.28 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.176 176.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.76 115.68 2.5 Favored 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 122.782 2.321 . . . . 0.0 112.434 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -64.46 108.19 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.363 1.065 . . . . 0.0 109.956 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -155.79 36.07 0.35 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.345 0.658 . . . . 0.0 110.771 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.95 120.95 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.019 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -78.3 89.63 4.34 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.808 0.843 . . . . 0.0 109.887 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -81.99 -28.99 39.53 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 46.1 t -116.11 83.1 1.89 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.657 1.183 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.42 -50.75 4.86 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.207 1.003 . . . . 0.0 110.029 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -161.0 132.8 5.74 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.241 1.016 . . . . 0.0 109.785 177.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -89.33 94.57 9.95 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -112.64 99.3 7.83 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 177.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -70.2 132.29 45.53 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.747 0.419 . . . . 0.0 110.191 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.38 111.19 7.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.24 89.43 5.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.49 152.89 37.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.185 -179.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.405 ' HG2' ' H ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -138.9 163.98 30.89 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.431 0.292 . . . . 0.0 110.78 -171.11 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 14.8 t -127.78 44.71 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 171.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.405 ' H ' ' HG2' ' A' ' 90' ' ' LYS . 38.9 mm -84.9 -9.95 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.146 177.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.24 65.03 0.81 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.066 1.346 . . . . 0.0 111.266 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -116.86 78.36 1.2 Allowed 'General case' 0 C--O 1.242 0.682 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 43.7 p -75.62 94.48 3.2 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.903 176.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -56.07 129.71 41.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.489 0.716 . . . . 0.0 110.719 -178.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -64.62 102.79 0.6 Allowed 'General case' 0 CA--C 1.537 0.46 0 O-C-N 123.73 0.644 . . . . 0.0 110.408 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.541 ' HB3' HD11 ' A' ' 102' ' ' LEU . 19.6 t-20 -77.61 -176.65 4.4 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -60.21 146.17 44.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.099 0.409 . . . . 0.0 109.96 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -52.41 -19.64 2.31 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.18 1.392 . . . . 0.0 112.92 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -36.81 -65.89 0.26 Allowed 'General case' 0 C--O 1.247 0.925 0 C-N-CA 126.902 2.081 . . . . 0.0 113.881 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.541 HD11 ' HB3' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -76.36 -33.07 58.94 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 119.156 -0.45 . . . . 0.0 112.045 -173.446 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -59.73 -41.51 91.09 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.198 0.454 . . . . 0.0 109.91 174.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.99 -46.33 78.4 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.291 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.49 96.39 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.312 1.008 . . . . 0.0 112.345 -177.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 102' ' ' LEU . 49.0 mm -72.48 -45.27 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.443 0.697 . . . . 0.0 110.688 -176.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -28.13 65.71 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.949 0.5 . . . . 0.0 111.289 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 33.2 tp -71.01 -46.09 62.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.212 0.605 . . . . 0.0 109.39 175.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -58.38 -36.03 72.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.768 0.667 . . . . 0.0 110.813 175.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.14 -49.43 69.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 110.115 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.7 pp -71.78 -34.96 69.87 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.168 0.293 . . . . 0.0 111.295 -175.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.07 -38.85 63.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.119 0.567 . . . . 0.0 112.102 -177.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.8 p -66.68 142.09 97.33 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.584 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -55.56 135.72 70.65 Favored 'Trans proline' 0 C--N 1.38 2.188 0 C-N-CA 122.331 2.02 . . . . 0.0 111.972 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.419 ' HE3' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -66.97 -23.64 65.97 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.745 0.818 . . . . 0.0 110.274 178.681 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 45.7 mm -68.97 108.18 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.347 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -103.89 6.64 36.56 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.676 0.79 . . . . 0.0 110.545 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.456 ' O ' ' HG2' ' A' ' 121' ' ' ARG . . . -151.42 93.8 1.94 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.115 0.966 . . . . 0.0 109.606 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 56.27 -78.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 126.093 1.757 . . . . 0.0 113.487 172.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.67 39.14 0.12 Allowed Glycine 0 C--N 1.342 0.877 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 118' ' ' ALA . 26.9 mmm180 -68.71 -46.03 70.05 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.568 0.747 . . . . 0.0 111.593 -174.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 73.71 -13.87 0.7 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.913 1.285 . . . . 0.0 112.755 177.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -95.37 95.08 8.22 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 -178.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -163.39 145.3 9.7 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.831 0.852 . . . . 0.0 109.627 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 62.01 28.54 17.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -71.52 88.72 0.93 Allowed 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 122.314 1.054 . . . . 0.0 111.415 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -135.73 130.92 34.9 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.216 1.006 . . . . 0.0 108.336 174.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -147.01 -57.31 0.26 Allowed 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -143.75 97.34 3.05 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.733 0.813 . . . . 0.0 109.542 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 41.5 m -72.35 85.1 1.09 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.268 0.627 . . . . 0.0 109.357 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 18.0 m -94.86 -55.65 3.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.606 0.762 . . . . 0.0 110.062 -178.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.946 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.781 -176.667 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.2 tpt -54.19 -51.58 63.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.437 1.095 . . . . 0.0 111.867 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -57.42 -35.44 70.08 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.174 0.989 . . . . 0.0 112.718 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.635 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.9 mm? -68.83 -46.48 68.46 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -69.55 -39.01 77.7 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.292 0.995 . . . . 0.0 110.529 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -62.26 -53.21 58.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.304 1.042 . . . . 0.0 110.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -58.15 -47.92 81.86 Favored 'General case' 0 C--N 1.36 1.043 0 O-C-N 123.862 0.726 . . . . 0.0 110.349 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -53.02 -42.23 65.48 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.764 1.225 . . . . 0.0 111.404 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.66 -46.47 79.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.041 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.5 pt -96.02 2.33 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 113.512 0.931 . . . . 0.0 113.512 -171.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.515 HG21 HD12 ' A' ' 58' ' ' LEU . 69.1 p -110.0 -41.78 4.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.049 0.54 . . . . 0.0 109.831 169.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.61 7.18 59.2 Favored Glycine 0 C--N 1.343 0.949 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.678 -176.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.572 HD12 HD13 ' A' ' 58' ' ' LEU . 79.0 mt -95.74 110.08 23.72 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 C-N-CA 124.053 0.941 . . . . 0.0 109.306 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -77.5 -17.74 57.7 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.9 0.88 . . . . 0.0 111.107 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 3.0 m-20 -65.19 108.08 1.84 Allowed Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 124.997 1.319 . . . . 0.0 110.011 -177.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.28 -26.75 35.28 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 123.114 2.543 . . . . 0.0 112.384 -171.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.7 t -62.39 -47.83 82.43 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.025 0.53 . . . . 0.0 109.858 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -57.89 -36.15 72.01 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.07 0.856 . . . . 0.0 111.492 176.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.528 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 mt -71.22 -51.12 26.47 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 123.972 0.795 . . . . 0.0 111.216 -174.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -60.62 -42.35 96.68 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.237 0.615 . . . . 0.0 111.585 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.487 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 40.4 mt-10 -65.99 -35.59 80.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.119 0.568 . . . . 0.0 112.144 -179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -44.77 66.43 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 123.536 0.523 . . . . 0.0 110.572 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.7 mm? -61.67 -35.55 78.29 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 124.187 0.929 . . . . 0.0 110.172 176.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.487 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.7 tmmm? -68.38 -45.29 73.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.843 0.857 . . . . 0.0 110.174 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.95 -17.97 63.34 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.789 0.836 . . . . 0.0 112.018 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 77.4 p -103.72 0.76 30.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.735 0.814 . . . . 0.0 111.507 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.0 m120 65.0 14.69 9.52 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.963 1.305 . . . . 0.0 112.435 -178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.59 12.46 Favored Glycine 0 C--N 1.353 1.472 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.873 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -79.14 99.26 6.89 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 117.571 0.685 . . . . 0.0 109.521 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 55' ' ' VAL . 17.5 tt -61.05 -29.29 45.4 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.306 0.642 . . . . 0.0 112.518 -172.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 26.8 m -64.78 -47.73 77.06 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.896 0.478 . . . . 0.0 110.608 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -63.37 -35.67 81.16 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.562 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.78 89.22 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.118 0.886 . . . . 0.0 111.274 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 51' ' ' ILE . 41.1 t -59.0 -51.84 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.466 174.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.7 t -57.71 -39.66 77.75 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.949 1.405 . . . . 0.0 111.195 -175.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.72 -29.94 61.35 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.139 0.576 . . . . 0.0 111.808 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.572 HD13 HD12 ' A' ' 34' ' ' ILE . 72.5 mt -76.26 -38.08 56.73 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 123.239 0.337 . . . . 0.0 111.821 173.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.3 p -86.05 -28.3 24.2 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.477 ' HA ' HG12 ' A' ' 63' ' ' VAL . 39.2 m-20 -67.79 -21.92 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.27 -37.77 78.45 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.228 0.611 . . . . 0.0 111.359 175.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -98.54 -9.34 25.07 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -176.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.477 HG12 ' HA ' ' A' ' 60' ' ' ASP . 9.6 p -125.26 16.73 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 CA-C-N 118.345 0.52 . . . . 0.0 111.103 -177.159 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -65.45 98.22 0.34 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 121.619 0.723 . . . . 0.0 111.016 176.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -135.4 114.43 11.43 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 173.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -72.55 138.31 54.08 Favored 'Cis proline' 0 C--N 1.387 2.603 0 CA-C-N 119.861 0.986 . . . . 0.0 113.676 6.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -84.4 -3.13 58.13 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.43 1.092 . . . . 0.0 112.063 -174.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -64.8 142.96 58.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.373 0.669 . . . . 0.0 109.848 177.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.95 108.12 3.88 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.265 0.626 . . . . 0.0 110.7 -175.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 t -74.76 173.29 10.74 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.711 0.804 . . . . 0.0 110.501 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.2 m -81.28 61.35 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 CA-C-O 121.9 0.857 . . . . 0.0 110.685 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.98 69.6 6.39 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.257 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 m -147.28 111.87 5.29 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -104.43 151.81 39.22 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 123.758 0.823 . . . . 0.0 110.771 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.32 122.88 12.56 Favored 'Trans proline' 0 C--N 1.381 2.24 0 C-N-CA 123.067 2.511 . . . . 0.0 111.644 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.9 m -101.97 110.12 22.02 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.538 0.735 . . . . 0.0 110.075 178.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -80.2 -16.8 54.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.686 0.794 . . . . 0.0 111.258 178.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.17 109.35 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.52 0.728 . . . . 0.0 110.7 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -73.76 109.97 7.69 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.383 0.673 . . . . 0.0 109.253 177.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.39 -27.01 67.06 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.75 0.656 . . . . 0.0 113.112 178.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 78.4 p 49.59 42.24 22.73 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.406 1.482 . . . . 0.0 111.952 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.31 72.14 5.29 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.316 -171.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -118.22 115.16 24.2 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 109.724 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -130.8 103.81 6.8 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.328 0.651 . . . . 0.0 109.644 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -106.99 104.65 14.37 Favored 'General case' 0 C--O 1.244 0.806 0 C-N-CA 123.584 0.754 . . . . 0.0 109.426 176.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -144.68 124.12 13.13 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.706 0.802 . . . . 0.0 109.534 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.51 140.36 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 168.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 tp -96.63 46.65 1.06 Allowed 'General case' 0 CA--C 1.55 0.974 0 CA-C-O 122.521 1.153 . . . . 0.0 108.435 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -132.13 148.83 52.5 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.743 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 tpmt? -76.64 134.21 39.37 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.861 0.725 . . . . 0.0 109.59 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 15.6 m -103.79 51.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 121.586 0.708 . . . . 0.0 110.927 -172.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 69.4 mt -63.61 -31.58 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.836 176.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 103.39 0.1 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.983 0.913 . . . . 0.0 110.362 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -175.18 -31.43 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.961 1.305 . . . . 0.0 108.044 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.8 p -57.49 93.73 0.01 OUTLIER 'General case' 0 C--N 1.362 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 111.56 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -70.57 -41.16 72.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.986 0.914 . . . . 0.0 109.776 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -81.09 157.24 25.45 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.33 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -84.12 172.62 11.78 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.713 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.2 153.39 20.41 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.524 0.73 . . . . 0.0 109.282 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.501 ' HA ' ' NE2' ' A' ' 103' ' ' GLN . 24.9 t70 -83.65 65.98 8.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 170.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -104.15 -73.82 0.66 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.151 -1.386 . . . . 0.0 109.907 -170.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.418 HD13 ' H ' ' A' ' 102' ' ' LEU . 0.0 OUTLIER -70.16 -20.89 63.12 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.028 0.531 . . . . 0.0 111.579 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.501 ' NE2' ' HA ' ' A' ' 100' ' ' ASP . 1.0 OUTLIER -59.58 -54.79 42.47 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 171.665 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -28.93 65.46 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.407 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.415 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . . . -69.15 -50.9 43.6 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.453 0.701 . . . . 0.0 111.381 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.18 -41.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.422 0.689 . . . . 0.0 109.943 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.14 74.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.269 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.6 tp -68.54 -41.01 80.47 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.482 0.713 . . . . 0.0 111.542 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -65.56 -41.44 92.95 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.975 0.51 . . . . 0.0 111.367 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -82.44 -15.14 53.67 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.898 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -72.58 -46.98 51.69 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 170.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -84.71 -2.5 57.66 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.33 0.652 . . . . 0.0 112.464 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.2 m -55.16 148.43 30.26 Favored Pre-proline 0 N--CA 1.487 1.384 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.728 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.28 89.65 0.03 OUTLIER 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.84 3.026 . . . . 0.0 112.678 -174.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.516 ' HA ' HH21 ' A' ' 121' ' ' ARG . 4.1 tppp? -74.73 121.36 21.61 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.669 -174.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.511 ' HB ' ' HG3' ' A' ' 121' ' ' ARG . 10.7 tp -99.98 152.37 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -177.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -115.5 -37.69 3.94 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 175.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -173.93 128.13 0.39 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.709 0.804 . . . . 0.0 109.41 177.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 67.94 99.74 0.05 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.683 1.193 . . . . 0.0 111.164 176.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.56 -120.33 0.94 Allowed Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.516 HH21 ' HA ' ' A' ' 115' ' ' LYS . 5.0 ppt_? -73.02 -7.18 50.04 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 117.425 0.612 . . . . 0.0 110.808 176.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.2 -28.84 59.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.847 1.259 . . . . 0.0 111.066 167.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 5.4 tt -75.99 79.9 2.86 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.42 -12.39 20.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.493 1.117 . . . . 0.0 108.316 165.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.43 158.08 44.76 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 125.214 1.405 . . . . 0.0 108.409 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 56.4 mtt -118.75 89.27 3.09 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.236 0.614 . . . . 0.0 109.424 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -89.79 131.11 35.91 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -157.97 139.44 13.64 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.722 0.809 . . . . 0.0 109.716 -177.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.39 113.78 27.54 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.972 0.909 . . . . 0.0 109.349 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 8.4 t -95.4 109.91 22.02 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 121.512 0.673 . . . . 0.0 109.85 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 46.3 t -115.58 140.81 48.82 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.859 0.864 . . . . 0.0 109.295 176.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.354 0.661 . . . . 0.0 109.642 -179.017 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.548 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 110.807 -0.071 . . . . 0.0 110.807 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -54.89 -50.51 68.58 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.489 0.716 . . . . 0.0 111.901 -177.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.594 ' H ' HD23 ' A' ' 24' ' ' LEU . 1.8 pt? -63.91 -36.13 82.93 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.633 1.173 . . . . 0.0 111.923 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.8 mm? -63.85 -45.66 88.53 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.246 0.618 . . . . 0.0 110.247 176.074 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -74.12 -37.23 64.15 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.064 0.853 . . . . 0.0 110.983 -172.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -59.98 -52.48 65.2 Favored 'General case' 0 C--N 1.356 0.852 0 O-C-N 124.008 0.817 . . . . 0.0 109.743 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 44' ' ' LEU . 13.2 tp -62.0 -45.22 94.58 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.338 1.024 . . . . 0.0 110.954 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -58.3 -39.31 78.99 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.994 0.918 . . . . 0.0 111.583 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.78 -50.78 61.57 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.596 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.0 pt -81.61 -19.77 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.531 HG21 HD12 ' A' ' 58' ' ' LEU . 80.6 p -99.35 -42.77 6.84 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.026 0.53 . . . . 0.0 110.556 178.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.12 -0.05 57.28 Favored Glycine 0 N--CA 1.469 0.849 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.329 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.713 HD12 HD13 ' A' ' 58' ' ' LEU . 95.4 mt -80.42 111.5 17.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.852 0.861 . . . . 0.0 109.524 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -75.04 -34.77 61.9 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.783 0.833 . . . . 0.0 110.527 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -56.51 106.65 0.71 Allowed Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 124.457 1.103 . . . . 0.0 111.241 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.543 ' HA ' HD12 ' A' ' 40' ' ' LEU . 59.8 Cg_endo -68.45 -21.16 40.9 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 122.897 2.398 . . . . 0.0 112.103 -175.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -66.69 -44.64 81.21 Favored 'General case' 0 C--N 1.349 0.579 0 C-N-CA 123.541 0.736 . . . . 0.0 110.862 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.448 ' HB3' HG21 ' A' ' 34' ' ' ILE . 2.0 t80 -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.285 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 37' ' ' PRO . 47.4 mt -72.21 -42.82 65.32 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.649 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -60.36 -43.13 96.83 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.273 0.629 . . . . 0.0 110.908 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.551 ' HA ' ' HE3' ' A' ' 45' ' ' LYS . 44.3 mt-10 -63.09 -39.03 93.51 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.623 0.769 . . . . 0.0 111.471 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.42 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -65.79 -46.72 77.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.319 0.648 . . . . 0.0 111.506 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.558 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -66.82 -30.49 70.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.038 0.935 . . . . 0.0 110.753 -179.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -75.1 -40.68 59.79 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.112 0.965 . . . . 0.0 110.108 179.018 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.57 -35.16 80.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.633 0.773 . . . . 0.0 110.365 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 m -91.12 -3.53 57.01 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.473 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 62.59 20.91 12.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.232 1.413 . . . . 0.0 112.607 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 120.93 -5.25 11.36 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 119.426 -0.652 . . . . 0.0 113.483 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -87.17 115.51 24.61 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.443 0.621 . . . . 0.0 111.012 -178.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.0 tp -66.0 -32.28 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 123.916 0.886 . . . . 0.0 111.733 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -66.44 -47.44 73.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.088 0.955 . . . . 0.0 111.786 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -69.13 -38.24 78.75 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 176.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.98 67.63 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 123.794 0.683 . . . . 0.0 111.893 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.53 -39.93 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.86 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -61.97 -31.3 71.63 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.174 0.59 . . . . 0.0 111.854 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.9 mt -83.17 -36.3 24.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.994 0.918 . . . . 0.0 111.518 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 HD12 ' A' ' 34' ' ' ILE . 53.2 mt -73.15 -29.15 62.67 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 177.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.458 ' O ' HG23 ' A' ' 63' ' ' VAL . 46.2 p -77.97 -30.5 50.29 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 122.766 0.427 . . . . 0.0 110.063 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -57.65 -29.98 65.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.624 0.77 . . . . 0.0 111.54 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -53.94 -46.99 71.7 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.933 1.293 . . . . 0.0 111.726 175.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -90.94 -17.26 26.68 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.392 0.677 . . . . 0.0 111.605 -177.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 59' ' ' THR . 87.7 t -67.94 -32.12 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -61.98 98.26 0.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.539 0.736 . . . . 0.0 110.602 174.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.45 150.29 84.64 Favored Pre-proline 0 CA--C 1.56 1.337 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.975 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -77.77 133.65 31.2 Favored 'Cis proline' 0 C--N 1.381 2.279 0 CA-C-N 120.324 1.151 . . . . 0.0 113.188 2.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.8 p -92.6 130.34 38.26 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 172.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.71 168.09 17.34 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 123.579 0.549 . . . . 0.0 111.43 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -78.61 107.44 11.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.4 p -68.5 107.65 2.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.249 177.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.3 m -65.16 152.91 8.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.876 0.87 . . . . 0.0 111.721 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -108.08 102.97 12.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.784 0.834 . . . . 0.0 109.063 174.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.4 t -93.24 145.77 24.19 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.236 0.615 . . . . 0.0 110.983 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.81 134.9 22.89 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.196 0.998 . . . . 0.0 109.771 -178.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -75.69 175.06 11.79 Favored 'Trans proline' 0 C--N 1.377 2.038 0 C-N-CA 122.894 2.396 . . . . 0.0 112.94 -178.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.0 p -65.25 111.26 2.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.256 1.022 . . . . 0.0 111.841 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.07 -38.87 24.25 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.94 0.896 . . . . 0.0 111.415 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 60.5 t -75.92 94.54 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.117 0.567 . . . . 0.0 109.818 -177.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -178.98 6.52 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.491 0.716 . . . . 0.0 111.05 178.117 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -144.14 51.72 0.63 Allowed Glycine 0 C--N 1.338 0.672 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 t -101.01 122.58 43.79 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.281 1.033 . . . . 0.0 109.61 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 78.46 1.42 Allowed 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -112.9 98.99 7.53 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.958 0.903 . . . . 0.0 110.056 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -161.57 99.63 1.15 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 108.75 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.37 107.97 7.43 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.435 0.694 . . . . 0.0 109.227 -179.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -140.94 122.33 14.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.73 0.812 . . . . 0.0 109.576 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 85.0 t -105.08 117.87 51.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.564 ' H ' HD23 ' A' ' 88' ' ' LEU . 1.0 OUTLIER -108.13 61.7 0.61 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.508 1.147 . . . . 0.0 108.935 178.598 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -125.52 148.22 48.96 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.912 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.503 ' HB2' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -160.02 159.93 32.65 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.092 0.472 . . . . 0.0 110.354 -174.99 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.4 t -121.26 36.78 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 168.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.503 HG12 ' HB2' ' A' ' 90' ' ' LYS . 39.9 mm -83.59 70.13 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -162.21 104.22 1.13 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.632 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.15 49.49 2.08 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 t -71.8 124.65 25.27 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.202 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -164.93 144.09 6.82 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.773 0.829 . . . . 0.0 109.101 176.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -140.48 148.85 41.74 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.339 0.656 . . . . 0.0 109.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -111.88 126.32 54.98 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 101' ' ' ASP . 52.6 tptt -64.61 157.48 26.95 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.866 0.866 . . . . 0.0 110.312 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.2 -16.87 44.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.022 0.529 . . . . 0.0 111.579 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ASP . . . . . 0.416 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 3.3 m-20 -73.6 -49.36 26.62 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -170.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.37 77.5 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.349 0.522 . . . . 0.0 110.65 176.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -61.74 -50.37 72.67 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.797 0.686 . . . . 0.0 109.98 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.19 -31.81 70.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.6 1.187 . . . . 0.0 111.651 -176.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -72.02 -46.57 56.61 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.599 0.76 . . . . 0.0 111.161 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.9 mm -67.66 -39.3 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.419 0.687 . . . . 0.0 109.596 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.39 97.03 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.09 0.956 . . . . 0.0 111.43 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.37 -40.64 85.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 0.0 109.239 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 t -65.55 -41.29 93.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.297 0.639 . . . . 0.0 111.419 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 39.8 tp -68.3 -52.54 32.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.256 0.622 . . . . 0.0 110.181 -177.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.19 -30.59 69.72 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.383 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 38.81 43.42 0.73 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.944 1.698 . . . . 0.0 112.293 -171.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.0 p -55.44 130.56 70.11 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.288 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.16 125.95 20.89 Favored 'Trans proline' 0 C--N 1.385 2.485 0 C-N-CA 123.108 2.539 . . . . 0.0 111.628 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -86.81 44.58 1.18 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.815 0.846 . . . . 0.0 110.935 -175.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.537 HD11 ' HB2' ' A' ' 123' ' ' LEU . 48.2 mt -72.39 92.29 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.687 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 173.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -107.74 77.84 1.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ALA . . . . . 0.404 ' O ' ' HG2' ' A' ' 121' ' ' ARG . . . 68.88 -72.37 0.1 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.486 1.514 . . . . 0.0 111.635 -176.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.66 -12.37 57.98 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.479 1.112 . . . . 0.0 113.286 -174.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -84.6 24.1 6.85 Favored Glycine 0 C--N 1.355 1.621 0 CA-C-O 119.531 -0.594 . . . . 0.0 114.011 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 118' ' ' ALA . 29.5 mmm180 -45.64 -23.14 0.21 Allowed 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 126.335 1.854 . . . . 0.0 114.148 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.29 -40.38 64.68 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.189 1.396 . . . . 0.0 113.155 -176.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.537 ' HB2' HD11 ' A' ' 116' ' ' ILE . 65.5 mt -97.55 32.68 2.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.613 0.765 . . . . 0.0 111.347 -174.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -63.1 135.75 57.39 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 0.0 110.382 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -74.73 99.46 3.72 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 121.379 0.609 . . . . 0.0 110.629 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 85.4 mtp -89.71 143.81 26.5 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.944 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -162.18 111.02 1.44 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 42.19 23.37 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 125.966 1.706 . . . . 0.0 114.325 -170.253 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -116.22 78.48 1.2 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.549 1.14 . . . . 0.0 107.994 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 47.3 p -63.07 -53.83 47.55 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.746 -177.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 57.4 p -83.84 116.47 22.76 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.082 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.965 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 . . . . . 0 CA--C 1.556 1.209 0 CA-C-O 120.779 0.323 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ttt -55.2 -43.77 74.74 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.797 0.839 . . . . 0.0 112.64 -170.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.541 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -62.08 -38.25 88.14 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.541 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.5 mm? -65.58 -46.15 80.54 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 176.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -64.45 -50.14 68.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.944 -174.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.28 71.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 112.047 -177.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.562 HD11 HD12 ' A' ' 58' ' ' LEU . 2.3 tm? -68.34 -38.07 81.15 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.2 -177.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -65.54 -35.65 81.48 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.178 0.591 . . . . 0.0 110.941 172.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.64 -39.12 92.86 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.58 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.2 pt -96.41 -13.97 7.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.7 p -102.43 -51.83 3.25 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.05 0.841 . . . . 0.0 110.89 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.75 7.22 42.31 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.378 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.657 HD12 HD13 ' A' ' 58' ' ' LEU . 60.6 mt -86.81 123.32 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.03 0.532 . . . . 0.0 110.891 -175.219 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -88.66 -11.63 44.74 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.98 0.912 . . . . 0.0 111.932 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.52 111.74 10.57 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-O 118.653 -0.689 . . . . 0.0 109.702 175.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.88 -36.92 81.31 Favored 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.014 2.476 . . . . 0.0 112.256 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.473 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 55.6 m -62.69 -48.9 77.3 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.577 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -52.76 -40.67 63.36 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.232 1.013 . . . . 0.0 112.127 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 28' ' ' LEU . 27.6 mt -66.26 -47.87 72.32 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 124.2 0.938 . . . . 0.0 109.788 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -61.19 -42.09 97.96 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.218 175.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 38' ' ' SER . 14.1 mm-40 -69.85 -32.98 71.66 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.356 1.063 . . . . 0.0 110.669 -174.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.87 -46.86 70.52 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 123.975 0.797 . . . . 0.0 110.672 175.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.431 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.6 mm? -64.31 -34.81 78.99 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.878 0.871 . . . . 0.0 109.939 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 4.1 tmmm? -69.98 -42.21 73.42 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.224 1.01 . . . . 0.0 110.244 178.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.63 -22.19 60.07 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.825 0.85 . . . . 0.0 111.358 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -104.38 5.2 34.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.287 0.635 . . . . 0.0 111.642 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 66.31 17.57 10.73 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.228 1.011 . . . . 0.0 111.529 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.49 -3.36 24.9 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.72 178.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -82.59 111.54 18.67 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.555 0.742 . . . . 0.0 110.087 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.446 HG13 HD23 ' A' ' 28' ' ' LEU . 20.6 tt -74.33 -24.6 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 122.742 0.417 . . . . 0.0 111.915 -174.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.7 m -71.66 -44.81 63.63 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.587 0.755 . . . . 0.0 110.535 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -71.45 -34.66 70.44 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.119 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -51.72 68.34 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.646 0.778 . . . . 0.0 112.242 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.43 -39.28 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 122.581 0.352 . . . . 0.0 110.741 175.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.2 t -59.82 -31.38 69.68 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.012 0.525 . . . . 0.0 111.719 178.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 88.0 mt -78.92 -41.33 29.76 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.207 0.603 . . . . 0.0 111.552 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.657 HD13 HD12 ' A' ' 34' ' ' ILE . 74.1 mt -76.22 -21.06 56.86 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 63' ' ' VAL . 42.9 p -84.41 -2.6 57.42 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.879 0.472 . . . . 0.0 111.741 176.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.468 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 18.2 t70 -50.59 -28.64 9.1 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.657 1.183 . . . . 0.0 112.855 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -47.2 -49.37 23.02 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.504 1.122 . . . . 0.0 111.866 175.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -100.47 -8.3 23.31 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.981 0.913 . . . . 0.0 112.091 -177.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 59' ' ' THR . 86.7 t -74.06 -54.34 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 174.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 60' ' ' ASP . 25.0 pttm -72.74 101.61 3.14 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 122.044 0.926 . . . . 0.0 110.064 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 152.47 51.31 Favored Pre-proline 0 CA--C 1.564 1.486 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 177.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.04 112.07 2.16 Favored 'Cis proline' 0 C--N 1.383 2.347 0 CA-C-N 120.599 1.25 . . . . 0.0 111.61 -6.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.4 m -64.96 -55.22 20.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.646 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -106.67 116.0 31.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -76.85 114.0 15.14 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 123.717 0.636 . . . . 0.0 109.613 178.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.5 t -99.61 170.7 8.4 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.523 0.729 . . . . 0.0 110.121 177.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 m -91.65 168.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.747 0.819 . . . . 0.0 110.349 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -140.74 110.34 6.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.232 0.613 . . . . 0.0 109.967 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.8 m -102.91 87.69 3.0 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 123.507 0.723 . . . . 0.0 109.597 -178.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -83.46 128.73 63.0 Favored Pre-proline 0 CA--C 1.553 1.066 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.226 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -80.27 -165.61 0.35 Allowed 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 123.063 2.509 . . . . 0.0 112.041 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.4 m -65.71 127.97 34.09 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.009 0.524 . . . . 0.0 111.325 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -101.01 -16.49 17.12 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.562 0.745 . . . . 0.0 110.949 -178.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.5 m -67.81 162.44 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 122.69 0.396 . . . . 0.0 111.371 176.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -79.8 162.98 24.78 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.084 0.953 . . . . 0.0 111.356 -177.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -154.2 29.39 0.71 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.721 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.0 p -150.69 -176.35 5.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 110.645 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 72.79 17.97 4.26 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.947 1.299 . . . . 0.0 110.81 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.47 86.83 4.48 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 176.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -84.08 19.33 1.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.114 0.965 . . . . 0.0 112.656 -175.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 pttp 44.22 35.07 1.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 126.299 1.84 . . . . 0.0 113.587 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -122.07 102.47 8.17 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.017 0.927 . . . . 0.0 108.895 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.3 t -82.74 127.43 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -71.76 -36.71 70.48 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.092 0.557 . . . . 0.0 109.632 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.75 145.49 50.42 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.229 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.454 ' HD3' ' HB3' ' A' ' 93' ' ' ASP . 1.3 tpmt? -75.95 145.36 40.42 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 120.936 0.398 . . . . 0.0 110.625 -177.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 15.0 t -98.27 38.8 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 49.4 mt 56.11 77.42 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 125.03 1.332 . . . . 0.0 110.992 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.454 ' HB3' ' HD3' ' A' ' 90' ' ' LYS . 33.0 t70 -111.09 89.55 3.08 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.234 175.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 pp -110.48 26.15 11.0 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.114 0.966 . . . . 0.0 109.751 171.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.3 m -58.6 92.86 0.02 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.857 1.263 . . . . 0.0 111.797 -175.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -136.47 86.11 2.19 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.04 141.22 58.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.121 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -68.92 117.4 10.55 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.732 0.813 . . . . 0.0 110.67 -174.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -92.27 148.54 22.06 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.347 0.659 . . . . 0.0 109.933 177.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -84.55 101.71 12.31 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.334 0.654 . . . . 0.0 109.588 -176.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -129.02 -68.88 0.73 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -26.35 67.74 Favored 'General case' 0 C--N 1.349 0.565 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.225 -178.053 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -63.49 -55.53 23.3 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.43 -38.51 80.86 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.359 0.664 . . . . 0.0 111.751 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.82 -54.44 38.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.492 0.717 . . . . 0.0 111.807 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.16 -44.68 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.824 0.85 . . . . 0.0 110.583 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 111' ' ' LEU . . . -62.25 -49.53 75.34 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.716 0.806 . . . . 0.0 111.497 -176.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.82 -39.65 83.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.927 0.891 . . . . 0.0 110.228 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -68.07 -44.95 75.17 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.736 0.415 . . . . 0.0 111.148 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt -79.0 -15.74 57.85 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.049 0.54 . . . . 0.0 111.568 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 107' ' ' ALA . 1.9 tm? -74.47 -54.98 6.48 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 172.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -95.88 64.5 2.45 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.531 -176.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.3 m -98.57 153.15 38.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.311 176.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.16 125.81 14.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 122.344 2.029 . . . . 0.0 111.481 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -74.94 -27.89 60.37 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.935 0.494 . . . . 0.0 109.734 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 44.5 mm -54.47 104.37 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.861 0.865 . . . . 0.0 110.117 175.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.46 ' HG2' ' HA ' ' A' ' 122' ' ' ASP . 20.8 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.792 -175.239 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -117.42 -152.66 0.51 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.846 0.858 . . . . 0.0 109.869 178.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -65.41 -66.09 0.59 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.574 0.749 . . . . 0.0 111.766 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -141.45 27.91 2.35 Favored Glycine 0 N--CA 1.474 1.218 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -161.73 178.73 8.72 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.422 1.089 . . . . 0.0 109.035 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.46 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 22.3 m-20 -105.67 -64.58 1.13 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 173.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 98.4 mt -103.79 160.57 14.67 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.176 0.59 . . . . 0.0 110.704 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -148.96 159.41 44.23 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.07 0.948 . . . . 0.0 109.648 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -84.86 86.22 7.38 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.996 0.519 . . . . 0.0 110.445 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 90.7 mtp -113.47 158.22 20.97 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.523 168.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 57.76 72.82 0.5 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.213 1.005 . . . . 0.0 111.167 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.59 7.58 2.34 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 114.467 -1.242 . . . . 0.0 109.656 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -76.84 171.64 14.41 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.489 1.116 . . . . 0.0 111.774 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 4.7 t -145.89 145.53 30.75 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.136 0.574 . . . . 0.0 110.338 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 37.1 t -94.21 104.67 16.67 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.13 0.972 . . . . 0.0 110.57 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.044 173.806 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -63.29 -40.73 98.18 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.024 0.53 . . . . 0.0 111.421 -171.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.495 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.1 pt? -64.78 -35.14 80.13 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.83 0.852 . . . . 0.0 111.623 177.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.09 -53.24 58.17 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -64.67 -45.54 86.28 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.941 -173.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.9 mm-40 -61.4 -55.46 31.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.147 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.581 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.9 tp -59.76 -47.15 86.81 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 123.472 0.482 . . . . 0.0 110.45 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -53.37 -40.23 64.81 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.694 1.198 . . . . 0.0 111.857 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.76 -46.64 62.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.047 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 pt -89.9 -0.67 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.525 HG21 HD12 ' A' ' 58' ' ' LEU . 74.2 p -108.31 -46.98 3.61 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.682 0.793 . . . . 0.0 109.574 170.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.43 -8.28 40.67 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.467 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 75.0 mt -80.47 117.23 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.115 0.966 . . . . 0.0 110.486 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -83.48 -17.03 43.37 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.224 0.953 . . . . 0.0 111.22 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.72 108.8 2.41 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.116 0.966 . . . . 0.0 109.776 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.74 -30.31 59.35 Favored 'Trans proline' 0 C--N 1.379 2.136 0 C-N-CA 122.725 2.284 . . . . 0.0 112.517 -173.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.508 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 57.3 m -58.48 -52.59 64.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.018 0.527 . . . . 0.0 110.433 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -51.68 -35.08 41.2 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.303 1.041 . . . . 0.0 112.046 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.581 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.5 mt -70.96 -45.98 63.18 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 123.802 0.689 . . . . 0.0 110.643 -177.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -66.48 -37.02 84.18 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.712 0.405 . . . . 0.0 111.379 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 38' ' ' SER . 18.5 mm-40 -64.22 -46.21 84.86 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.226 1.01 . . . . 0.0 110.765 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -41.1 96.69 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.63 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.495 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.3 mm? -69.74 -37.49 76.48 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.387 0.675 . . . . 0.0 111.524 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -74.26 -36.57 63.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.433 0.293 . . . . 0.0 110.521 -176.944 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.574 ' HA ' ' HG3' ' A' ' 75' ' ' PRO . . . -77.64 -22.02 51.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.242 0.617 . . . . 0.0 111.804 -177.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.6 p -94.96 3.13 55.3 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.234 0.614 . . . . 0.0 111.795 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 75.92 -18.7 0.45 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 125.084 1.354 . . . . 0.0 112.004 -175.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 140.05 -7.16 2.91 Favored Glycine 0 C--N 1.343 0.929 0 N-CA-C 111.971 -0.452 . . . . 0.0 111.971 -172.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -78.23 107.27 10.72 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.038 0.535 . . . . 0.0 110.558 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.463 ' O ' HG23 ' A' ' 55' ' ' VAL . 13.3 tt -66.98 -26.63 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.5 m -67.03 -50.22 62.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.397 0.618 . . . . 0.0 110.207 177.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 16.5 mm100 -61.99 -36.06 80.36 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.612 176.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.75 90.94 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 123.758 0.823 . . . . 0.0 111.7 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -59.97 -45.48 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 173.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -58.71 -35.59 72.9 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.724 0.809 . . . . 0.0 111.756 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.3 mt -71.63 -40.03 70.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.31 0.644 . . . . 0.0 111.034 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.525 HD12 HG21 ' A' ' 32' ' ' THR . 51.9 mt -75.61 -25.15 56.71 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p -84.28 -18.69 35.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.463 0.305 . . . . 0.0 110.441 174.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.87 -35.5 76.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.486 0.715 . . . . 0.0 109.596 174.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -52.69 -44.63 66.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.141 1.376 . . . . 0.0 113.576 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -80.81 -3.26 50.44 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.232 0.613 . . . . 0.0 112.281 -173.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.3 p -139.81 30.58 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.284 0 CA-C-O 122.429 1.109 . . . . 0.0 109.543 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -84.8 5.23 29.45 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.375 1.07 . . . . 0.0 112.475 -170.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -106.14 159.8 28.41 Favored Pre-proline 0 CA--C 1.562 1.418 0 C-N-CA 124.146 0.978 . . . . 0.0 110.481 178.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -78.81 -45.02 0.44 Allowed 'Cis proline' 0 C--N 1.384 2.402 0 CA-C-N 120.791 1.318 . . . . 0.0 112.542 -4.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.0 t -133.23 81.12 1.92 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.0 mm-40 -107.59 59.28 0.62 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.85 107.3 0.38 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.867 -168.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 82.8 p -95.88 -174.6 3.17 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.953 0.901 . . . . 0.0 109.885 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.2 t -76.07 95.09 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 168.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -73.81 -12.42 60.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.76 0.824 . . . . 0.0 112.315 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.7 t -94.33 159.48 15.1 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 171.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -87.13 148.88 46.11 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 123.032 0.533 . . . . 0.0 110.995 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PRO . . . . . 0.574 ' HG3' ' HA ' ' A' ' 46' ' ' ALA . 38.8 Cg_endo -65.31 128.94 21.47 Favored 'Trans proline' 0 C--N 1.379 2.157 0 C-N-CA 122.354 2.036 . . . . 0.0 109.599 167.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.9 p -69.73 82.83 0.45 Allowed 'General case' 0 CA--C 1.548 0.869 0 CA-C-O 121.703 0.763 . . . . 0.0 111.028 -176.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.412 ' HG3' HG13 ' A' ' 78' ' ' VAL . 12.8 pt-20 -68.8 -26.57 65.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.969 175.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.412 HG13 ' HG3' ' A' ' 77' ' ' GLU . 27.4 m -116.33 144.47 23.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.81 0 C-N-CA 124.392 1.077 . . . . 0.0 109.541 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -108.39 146.67 32.7 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 124.303 1.041 . . . . 0.0 108.924 177.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.01 42.3 9.67 Favored Glycine 0 C--N 1.343 0.949 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -173.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.2 p -67.07 109.21 2.92 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.742 0.817 . . . . 0.0 110.753 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -85.9 62.62 7.57 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.672 0.789 . . . . 0.0 109.663 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -86.8 128.83 35.05 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.579 0.752 . . . . 0.0 109.291 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -63.97 100.62 0.32 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.835 0.854 . . . . 0.0 110.117 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.65 104.47 7.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 -177.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -97.51 164.22 12.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.434 0.694 . . . . 0.0 110.752 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.45 106.78 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -86.67 80.06 8.68 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.41 -168.39 1.48 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.95 0.9 . . . . 0.0 109.823 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -160.29 142.37 12.87 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.5 p -102.45 -9.18 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 123.153 0.581 . . . . 0.0 111.476 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.2 mt -72.79 -28.45 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.337 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.454 ' HB3' HG22 ' A' ' 95' ' ' THR . 8.9 m-20 -57.96 113.35 1.84 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.398 0.679 . . . . 0.0 110.141 172.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 pp -79.98 9.97 4.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.616 0.766 . . . . 0.0 112.021 -178.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.454 HG22 ' HB3' ' A' ' 93' ' ' ASP . 6.2 t -58.0 87.78 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.361 1.064 . . . . 0.0 112.926 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 p-80 179.23 150.62 0.31 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.945 1.698 . . . . 0.0 107.968 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -87.76 161.9 17.33 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.405 HD22 HD21 ' A' ' 102' ' ' LEU . 2.6 m-20 -74.52 155.65 37.72 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.988 0.515 . . . . 0.0 110.151 174.257 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.21 168.44 18.25 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.763 173.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.64 -15.03 57.6 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.101 0.56 . . . . 0.0 111.966 -176.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -63.46 -66.21 0.57 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.613 0.765 . . . . 0.0 111.808 -173.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.405 HD21 HD22 ' A' ' 98' ' ' ASN . 0.0 OUTLIER -64.24 -29.35 70.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.979 0.512 . . . . 0.0 111.646 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -64.31 -52.71 57.18 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.091 0.556 . . . . 0.0 110.944 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.64 -30.23 68.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.323 0.649 . . . . 0.0 111.498 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.88 -54.69 30.83 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.714 0.806 . . . . 0.0 110.941 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -70.76 -36.78 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.471 0.708 . . . . 0.0 110.773 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.35 -38.91 92.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.828 0.851 . . . . 0.0 111.123 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 52.3 tp -70.94 -41.19 71.48 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.7 m -63.58 -29.58 70.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.851 0.46 . . . . 0.0 111.259 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 56.5 tp -74.62 -41.01 61.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.171 0.989 . . . . 0.0 109.874 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 tt -67.78 -39.84 84.02 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.892 0.877 . . . . 0.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -96.38 13.61 27.18 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.851 0.861 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.2 t -67.63 130.84 93.01 Favored Pre-proline 0 N--CA 1.474 0.748 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -62.26 145.92 95.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 122.772 2.315 . . . . 0.0 112.215 -174.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -83.57 70.18 10.23 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.145 0.974 . . . . 0.0 109.223 -177.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 121' ' ' ARG . 47.9 mm -96.14 116.95 39.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.933 -177.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -93.11 45.4 1.17 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.191 0.996 . . . . 0.0 109.416 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.4 -170.69 0.85 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.939 1.296 . . . . 0.0 110.249 -175.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -86.0 -21.27 27.89 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.561 0.744 . . . . 0.0 111.593 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -170.5 76.01 0.1 Allowed Glycine 0 C--N 1.351 1.386 0 N-CA-C 111.829 -0.508 . . . . 0.0 111.829 -177.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.404 ' HA ' HD12 ' A' ' 116' ' ' ILE . 0.1 OUTLIER 64.02 153.64 0.05 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.545 1.538 . . . . 0.0 112.377 -173.898 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -165.7 -69.2 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.312 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 52.9 tp -74.59 107.8 6.94 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.772 -177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -139.19 133.46 31.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -122.97 78.05 1.51 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.301 0.64 . . . . 0.0 109.642 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.7 mtm 46.43 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 125.757 1.623 . . . . 0.0 114.696 164.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -56.77 -36.73 70.17 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.228 0.611 . . . . 0.0 110.343 174.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.82 93.5 1.69 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.086 170.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.15 114.32 15.84 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 175.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.3 p -71.57 128.25 35.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.009 0.524 . . . . 0.0 109.997 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 27.1 p -70.33 85.09 0.58 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.741 0.816 . . . . 0.0 110.088 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 C-N-CA 124.242 1.017 . . . . 0.0 108.707 -176.585 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 . . . . . 0 CA--C 1.555 1.138 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -36.38 76.34 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.677 0.791 . . . . 0.0 112.182 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.521 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.4 pt? -66.26 -39.43 89.46 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.589 0.756 . . . . 0.0 111.12 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.521 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -66.98 -46.94 73.07 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.12 0.568 . . . . 0.0 110.188 177.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -62.16 -52.05 65.4 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.64 1.213 . . . . 0.0 110.968 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -58.42 -53.7 55.4 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.204 0.94 . . . . 0.0 111.043 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.442 HD12 HD22 ' A' ' 40' ' ' LEU . 2.1 tm? -56.24 -50.75 70.41 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.259 0.974 . . . . 0.0 110.027 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.436 ' HB2' HD13 ' A' ' 40' ' ' LEU . 72.4 ttt180 -61.14 -33.73 73.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.117 0.967 . . . . 0.0 111.952 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -74.12 -40.41 62.69 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.568 0.747 . . . . 0.0 110.723 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 pt -95.18 -15.5 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.589 -169.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.402 HG22 HG13 ' A' ' 55' ' ' VAL . 72.9 p -96.36 -43.13 7.8 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.95 -4.69 61.18 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.868 -177.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.495 HD12 HD13 ' A' ' 58' ' ' LEU . 62.5 mt -75.3 120.36 24.81 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 123.756 0.822 . . . . 0.0 109.443 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -86.43 -17.55 34.01 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.57 0.748 . . . . 0.0 111.353 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -70.16 109.48 4.93 Favored Pre-proline 0 N--CA 1.483 1.18 0 C-N-CA 123.544 0.738 . . . . 0.0 110.205 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.6 -25.46 79.3 Favored 'Trans proline' 0 C--N 1.388 2.637 0 C-N-CA 123.217 2.611 . . . . 0.0 113.255 -175.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m -58.36 -51.74 68.54 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.662 0.601 . . . . 0.0 110.555 177.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.15 -36.46 79.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.733 0.813 . . . . 0.0 111.423 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.442 HD22 HD12 ' A' ' 28' ' ' LEU . 13.9 mt -68.2 -56.67 7.88 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 124.386 1.054 . . . . 0.0 109.521 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 59.1 m80 -59.86 -50.19 74.75 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.117 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -56.68 -40.21 75.15 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.568 0.747 . . . . 0.0 111.903 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.8 87.3 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.739 0.65 . . . . 0.0 110.873 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.428 HD23 ' O ' ' A' ' 40' ' ' LEU . 4.3 mm? -69.35 -23.53 63.78 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.825 0.85 . . . . 0.0 111.888 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -47.94 17.87 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.31 86.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 124.228 0.955 . . . . 0.0 110.943 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.9 m -89.58 -3.29 58.37 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.778 0.831 . . . . 0.0 111.908 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 64.2 21.94 12.7 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.69 1.196 . . . . 0.0 112.47 176.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.26 -8.56 24.79 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-O 119.675 -0.514 . . . . 0.0 113.218 178.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.06 111.86 13.09 Favored 'General case' 0 C--O 1.246 0.918 0 CA-C-N 117.329 0.564 . . . . 0.0 110.519 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 55' ' ' VAL . 5.7 tp -65.98 -34.46 70.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 C-N-CA 123.268 0.627 . . . . 0.0 111.351 -173.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 35.7 m -66.65 -49.97 64.47 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.823 0.849 . . . . 0.0 110.866 -173.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -64.28 -39.94 94.96 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.259 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.88 -52.89 59.05 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.071 0.857 . . . . 0.0 112.317 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.9 t -63.73 -44.0 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 122.973 0.509 . . . . 0.0 110.433 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 t -58.5 -43.67 89.15 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 124.261 0.976 . . . . 0.0 111.187 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.16 -30.23 62.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.957 -176.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.495 HD13 HD12 ' A' ' 34' ' ' ILE . 72.8 mt -72.33 -40.71 67.21 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.6 p -80.94 -11.19 59.62 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.868 0.467 . . . . 0.0 111.62 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.99 -21.87 61.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.768 0.827 . . . . 0.0 112.393 -178.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -57.56 -37.96 74.0 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.756 0.822 . . . . 0.0 112.672 -177.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.1 ptt85 -87.61 -19.68 27.44 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.821 0.848 . . . . 0.0 110.71 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.0 t -79.38 -30.49 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.493 0.717 . . . . 0.0 109.145 177.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.59 102.63 0.93 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.132 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.501 ' HA ' ' N ' ' A' ' 67' ' ' SER . 44.0 mt-10 -65.4 150.82 95.34 Favored Pre-proline 0 CA--C 1.554 1.107 0 C-N-CA 123.833 0.853 . . . . 0.0 111.914 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.11 109.1 0.86 Allowed 'Cis proline' 0 C--N 1.389 2.702 0 CA-C-N 120.255 1.127 . . . . 0.0 113.454 5.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.501 ' N ' ' HA ' ' A' ' 65' ' ' GLU . 49.6 m -76.97 108.13 9.8 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 123.953 0.901 . . . . 0.0 109.758 -179.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -152.23 148.67 27.84 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.604 1.161 . . . . 0.0 108.477 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 58.83 26.49 14.88 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.11 0.964 . . . . 0.0 110.674 -177.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.5 p -74.34 104.8 5.23 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 123.984 0.914 . . . . 0.0 110.637 -172.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.5 m -59.86 141.09 17.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.762 0.825 . . . . 0.0 111.044 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 89.93 0.29 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 0.0 110.527 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.1 m -124.64 54.1 1.41 Allowed 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.363 1.065 . . . . 0.0 108.338 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -100.78 144.77 29.17 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.264 -175.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -75.87 179.58 6.14 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.417 2.078 . . . . 0.0 111.348 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -80.03 70.67 6.66 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -83.58 82.46 8.29 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-O 121.799 0.809 . . . . 0.0 109.109 -175.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.7 m -93.13 176.32 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.746 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.45 109.82 7.26 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.26 87.11 0.14 Allowed Glycine 0 C--N 1.348 1.198 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.101 -178.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.7 t -59.33 93.98 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.095 0.958 . . . . 0.0 110.663 -178.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.68 74.92 7.49 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.286 1.035 . . . . 0.0 109.777 -174.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.73 141.14 53.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.872 174.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -61.94 -18.99 62.22 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.259 1.024 . . . . 0.0 112.798 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -91.81 73.52 5.74 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-O 121.751 0.786 . . . . 0.0 109.824 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -133.76 112.73 11.61 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.999 -1.001 . . . . 0.0 108.976 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.22 120.43 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -79.46 -30.37 42.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.793 0.437 . . . . 0.0 110.493 -178.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.23 127.05 31.52 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.349 0.66 . . . . 0.0 110.379 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -77.19 135.57 38.51 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.929 0.492 . . . . 0.0 111.03 -172.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.2 t -109.7 28.16 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-O 122.384 1.088 . . . . 0.0 109.071 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 mt -113.94 30.99 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 176.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -67.53 101.72 1.04 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.037 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.409 ' H ' HD13 ' A' ' 94' ' ' LEU . 0.0 OUTLIER -103.02 -16.26 15.85 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.508 0.723 . . . . 0.0 110.718 177.523 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.1 p -81.56 69.5 8.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.044 0.938 . . . . 0.0 111.407 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -92.61 -59.58 2.03 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.551 -178.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -96.05 43.85 1.08 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 122.47 1.129 . . . . 0.0 109.009 176.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -126.43 120.8 30.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -70.28 156.26 39.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.359 0.664 . . . . 0.0 109.722 174.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -77.96 73.84 4.52 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.716 0.769 . . . . 0.0 109.016 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -140.93 -72.1 0.35 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.323 -175.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -32.1 73.42 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.225 0.61 . . . . 0.0 110.365 175.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -62.82 -56.92 13.15 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.794 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.75 -33.31 75.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 124.095 0.872 . . . . 0.0 111.421 -176.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.05 -59.62 4.24 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.427 0.691 . . . . 0.0 111.517 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.46 -41.19 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.468 0.707 . . . . 0.0 110.776 -176.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.82 -42.55 90.47 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.258 0.623 . . . . 0.0 111.799 -178.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.34 -40.91 77.27 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.6 t -62.55 -43.89 97.69 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.502 0.721 . . . . 0.0 111.332 179.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.59 -47.78 45.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.788 0.835 . . . . 0.0 109.786 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 38.8 tp -71.83 -17.98 62.11 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.644 0.778 . . . . 0.0 110.926 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 47.29 36.22 4.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 126.379 1.871 . . . . 0.0 111.879 -177.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -143.84 139.57 16.27 Favored Pre-proline 0 C--O 1.24 0.596 0 CA-C-N 114.189 -1.369 . . . . 0.0 108.713 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.4 162.1 1.56 Allowed 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 123.592 2.861 . . . . 0.0 114.359 177.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.5 OUTLIER -67.66 -19.25 65.17 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.374 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.5 mt -96.07 139.36 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.91 0.884 . . . . 0.0 109.395 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -101.3 -55.32 2.57 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 161.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.98 -57.81 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.668 172.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -65.57 -16.35 63.62 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.03 -175.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.93 -28.87 73.96 Favored Glycine 0 C--N 1.355 1.631 0 C-N-CA 123.1 0.381 . . . . 0.0 113.238 -178.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 59.76 23.68 12.59 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.573 1.149 . . . . 0.0 112.424 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -90.18 46.22 1.33 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.195 0.998 . . . . 0.0 109.698 -174.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.97 98.27 0.94 Allowed 'General case' 0 C--N 1.355 0.806 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.093 -176.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -165.29 124.67 1.77 Allowed 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -148.63 29.79 0.83 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.1 mmt -92.14 158.26 16.28 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.557 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -71.77 143.13 49.67 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.696 0.398 . . . . 0.0 110.292 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -21.98 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.969 0.508 . . . . 0.0 111.049 173.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -84.44 116.86 23.3 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.006 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 60.7 m -67.99 -41.58 82.08 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.535 0.734 . . . . 0.0 110.268 176.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 54.6 p -79.79 125.78 30.12 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.162 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.002 0 C-N-CA 123.492 0.717 . . . . 0.0 109.913 178.126 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 120.914 0.388 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -56.61 -32.72 65.56 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.358 1.063 . . . . 0.0 113.136 -173.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -61.08 -46.44 90.62 Favored 'General case' 0 C--O 1.253 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 111.072 -178.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.522 HD22 ' HB2' ' A' ' 40' ' ' LEU . 44.3 mt -74.32 -42.58 59.23 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.817 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -62.92 -42.48 99.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.056 0.847 . . . . 0.0 111.247 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.47 ' O ' HG12 ' A' ' 31' ' ' ILE . 13.5 mm100 -63.26 -57.99 8.63 Favored 'General case' 0 C--N 1.356 0.851 0 CA-C-O 118.681 -0.676 . . . . 0.0 110.188 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' A' ' 40' ' ' LEU . 16.8 mt -51.49 -53.23 39.53 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 123.979 0.799 . . . . 0.0 111.387 176.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -53.14 -38.66 62.9 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.567 1.147 . . . . 0.0 112.162 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.49 -51.66 33.8 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.287 0.635 . . . . 0.0 110.846 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 27' ' ' GLN . 4.6 pt -91.28 4.03 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -172.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.464 HG21 HD12 ' A' ' 58' ' ' LEU . 45.3 p -122.1 -38.62 2.68 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.432 0.693 . . . . 0.0 110.344 175.283 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.94 -1.68 63.42 Favored Glycine 0 N--CA 1.475 1.287 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.488 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.44 ' HB ' HD21 ' A' ' 40' ' ' LEU . 86.0 mt -79.73 117.31 25.26 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 123.77 0.828 . . . . 0.0 109.922 -178.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -81.97 -18.6 42.9 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.739 0.649 . . . . 0.0 110.694 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 5.5 m-20 -68.77 104.88 0.81 Allowed Pre-proline 0 N--CA 1.481 1.076 0 C-N-CA 123.991 0.916 . . . . 0.0 109.747 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.71 -25.31 34.0 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.648 2.232 . . . . 0.0 111.799 -174.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.422 ' O ' ' HG3' ' A' ' 42' ' ' GLU . 42.8 m -66.61 -42.58 86.61 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.909 0.884 . . . . 0.0 110.806 177.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -66.08 -38.67 88.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.874 0.87 . . . . 0.0 109.821 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.522 ' HB2' HD22 ' A' ' 25' ' ' LEU . 56.5 mt -64.58 -41.42 96.27 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.604 175.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -62.5 -44.67 95.82 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 38' ' ' SER . 52.4 mt-10 -61.16 -37.87 84.44 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.587 0.555 . . . . 0.0 111.339 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.39 -48.15 62.04 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.786 0.679 . . . . 0.0 110.994 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.38 -40.62 78.55 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.397 1.079 . . . . 0.0 110.35 179.284 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.66 -37.04 59.93 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.295 1.038 . . . . 0.0 111.722 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -15.75 62.88 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.686 0.394 . . . . 0.0 111.547 178.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -106.94 11.27 30.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.853 0.861 . . . . 0.0 110.982 177.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 65.82 15.79 10.2 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.489 1.116 . . . . 0.0 112.827 175.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.15 -0.34 28.31 Favored Glycine 0 C--N 1.341 0.83 0 C-N-CA 123.36 0.505 . . . . 0.0 112.343 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -83.55 110.4 18.19 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 123.182 0.593 . . . . 0.0 111.078 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.58 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.1 tp -56.34 -38.71 56.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.707 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -58.43 -60.02 4.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.75 1.22 . . . . 0.0 112.279 -173.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.435 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 mm100 -66.93 -28.57 68.4 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.286 178.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.42 93.05 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.34 0.4 . . . . 0.0 111.019 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 51' ' ' ILE . 20.5 t -60.09 -46.99 93.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.131 0 O-C-N 123.762 0.664 . . . . 0.0 109.306 175.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.3 t -53.65 -50.41 65.82 Favored 'General case' 0 C--N 1.354 0.8 0 O-C-N 124.609 1.193 . . . . 0.0 111.683 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 89.3 mt -60.47 -44.13 96.22 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.689 0.618 . . . . 0.0 111.336 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.464 HD12 HG21 ' A' ' 32' ' ' THR . 71.6 mt -73.26 -30.88 63.74 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.427 ' O ' HG12 ' A' ' 63' ' ' VAL . 42.9 p -78.0 -26.64 48.69 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -77.57 -13.01 60.02 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.98 0.512 . . . . 0.0 111.0 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.36 51.82 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.793 0.437 . . . . 0.0 110.95 174.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -70.6 -38.17 73.97 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 59' ' ' THR . 13.3 p -112.26 49.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-O 122.731 1.253 . . . . 0.0 108.803 179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -75.61 92.66 2.96 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.09 -176.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.15 133.34 94.64 Favored Pre-proline 0 CA--C 1.559 1.318 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.569 -177.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -86.96 142.43 25.44 Favored 'Cis proline' 0 C--N 1.378 2.086 0 C-N-CA 124.708 -0.955 . . . . 0.0 112.433 -5.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.2 m -108.63 28.42 8.41 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.217 0.607 . . . . 0.0 110.144 176.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 65.38 13.36 8.77 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.27 1.428 . . . . 0.0 112.559 -176.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -107.5 -159.23 0.68 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.53 0.732 . . . . 0.0 109.81 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -95.97 35.71 1.38 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.066 0.547 . . . . 0.0 112.389 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.05 97.86 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.033 0.444 . . . . 0.0 110.043 173.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.45 74.72 4.98 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 9.8 t -88.35 150.67 23.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.564 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -95.84 150.29 37.16 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 124.401 1.08 . . . . 0.0 109.219 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.25 115.3 4.1 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.071 1.847 . . . . 0.0 109.749 174.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.0 t -51.41 117.92 2.95 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.751 0.82 . . . . 0.0 110.795 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -72.46 83.25 1.09 Allowed 'General case' 0 C--N 1.358 0.958 0 CA-C-O 121.869 0.842 . . . . 0.0 110.43 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.0 p -163.96 112.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.305 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -74.13 90.04 2.01 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.301 0.572 . . . . 0.0 109.823 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.96 51.59 3.19 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.688 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.9 m -147.81 127.04 12.97 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.111 0.965 . . . . 0.0 109.474 -176.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -150.84 6.91 0.53 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.792 0.837 . . . . 0.0 111.097 176.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.44 99.72 6.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.341 0.656 . . . . 0.0 110.184 -178.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -72.82 142.35 48.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.586 0.754 . . . . 0.0 110.238 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -142.99 107.47 4.8 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.34 0.656 . . . . 0.0 109.611 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.51 126.57 26.11 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.476 0.711 . . . . 0.0 110.014 179.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.469 HG12 ' H ' ' A' ' 89' ' ' ALA . 43.2 t -77.7 125.11 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 77.6 mt -88.4 11.29 17.28 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.308 0.643 . . . . 0.0 112.125 -174.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.469 ' H ' HG12 ' A' ' 87' ' ' VAL . . . -83.76 -177.64 6.76 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.792 0.837 . . . . 0.0 110.638 174.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.456 ' HE3' ' N ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -164.06 155.92 16.62 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.877 0.871 . . . . 0.0 109.985 179.806 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.4 m -109.89 33.87 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.365 1.066 . . . . 0.0 110.443 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.4 mt -86.85 76.22 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.178 0.99 . . . . 0.0 109.125 -175.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.94 133.61 37.2 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.553 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.87 -5.86 5.65 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.24 1.016 . . . . 0.0 111.106 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.8 p -76.91 106.21 8.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.309 0.643 . . . . 0.0 110.664 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -115.57 132.22 56.69 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -80.93 168.91 18.2 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.148 0.579 . . . . 0.0 111.855 -175.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -77.76 148.56 34.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.797 177.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.6 tptt -119.41 157.92 27.25 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -65.46 0.33 1.58 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.946 1.698 . . . . 0.0 114.366 -171.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -56.78 -67.44 0.31 Allowed 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 118.594 0.634 . . . . 0.0 111.301 -176.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -23.23 41.01 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.693 -177.033 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -59.64 -55.83 29.45 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.64 -31.44 68.37 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.337 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.09 -56.53 21.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.861 0.464 . . . . 0.0 111.134 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.47 -43.35 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.011 0.524 . . . . 0.0 110.776 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.67 68.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.916 0.887 . . . . 0.0 111.639 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.88 -41.19 75.12 Favored 'General case' 0 C--N 1.351 0.646 0 O-C-N 123.758 0.661 . . . . 0.0 111.331 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.8 m -64.61 -31.02 72.05 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 123.369 0.418 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.14 -33.43 33.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.821 0.848 . . . . 0.0 109.672 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.0 tp -74.21 -36.29 63.95 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.343 1.057 . . . . 0.0 111.34 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -88.52 -176.38 5.28 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.763 0.792 . . . . 0.0 110.904 -175.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.2 m -130.72 100.33 17.81 Favored Pre-proline 0 C--O 1.244 0.79 0 N-CA-C 104.935 -2.246 . . . . 0.0 104.935 171.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -45.6 146.5 3.51 Favored 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 124.137 3.224 . . . . 0.0 113.514 -172.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -24.46 7.77 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.666 1.187 . . . . 0.0 113.371 -170.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.44 HG22 ' H ' ' A' ' 117' ' ' GLN . 3.5 mt -78.34 -147.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.866 0 C-N-CA 124.476 1.111 . . . . 0.0 108.179 177.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.44 ' H ' HG22 ' A' ' 116' ' ' ILE . 18.5 mt-30 65.34 -70.28 0.09 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.255 1.422 . . . . 0.0 111.791 -173.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -109.72 -69.21 0.87 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.868 0.867 . . . . 0.0 111.322 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -90.78 19.57 5.4 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.911 0.884 . . . . 0.0 113.108 -166.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -129.49 -67.67 0.11 Allowed Glycine 0 C--N 1.348 1.197 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -179.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 54.5 75.62 0.28 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.693 1.197 . . . . 0.0 110.682 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -151.11 103.09 3.0 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 123.992 0.917 . . . . 0.0 109.004 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -129.28 58.65 1.61 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.253 1.021 . . . . 0.0 108.547 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -66.06 92.99 0.18 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.103 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -132.39 -49.15 0.91 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.91 100.66 8.99 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 113.983 -1.462 . . . . 0.0 108.714 171.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -88.76 145.11 25.81 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.682 -0.636 . . . . 0.0 110.141 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -91.97 147.4 22.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.01 0.524 . . . . 0.0 110.077 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 62.98 26.83 15.69 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.916 1.286 . . . . 0.0 112.154 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -69.96 105.02 2.69 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.409 0.684 . . . . 0.0 110.737 -177.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.0 t -142.77 -173.27 3.84 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.263 1.025 . . . . 0.0 108.471 177.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.632 0 C-N-CA 123.413 0.685 . . . . 0.0 110.624 -177.201 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 54.7 ttm . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.541 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.6 pt? -63.42 -37.26 86.59 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 40' ' ' LEU . 3.0 mm? -68.17 -44.48 75.83 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -65.84 -46.87 76.93 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.244 0.965 . . . . 0.0 111.044 -176.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.411 ' O ' HG12 ' A' ' 31' ' ' ILE . 4.6 mm100 -59.63 -56.42 22.12 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 124.699 1.249 . . . . 0.0 110.858 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 40' ' ' LEU . 18.7 tp -56.98 -48.26 78.83 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 124.095 0.872 . . . . 0.0 110.868 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -55.1 -41.93 72.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.751 0.82 . . . . 0.0 111.434 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.55 -44.05 83.42 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.234 1.014 . . . . 0.0 109.948 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.7 pt -97.66 2.26 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -171.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.536 HG21 HD12 ' A' ' 58' ' ' LEU . 68.0 p -114.11 -49.6 2.85 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 170.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 111.69 -10.59 27.87 Favored Glycine 0 C--N 1.338 0.68 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.784 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.717 HD12 HD13 ' A' ' 58' ' ' LEU . 90.5 mt -71.32 119.86 18.41 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 C-N-CA 123.399 0.68 . . . . 0.0 110.652 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -86.37 -20.63 27.99 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.139 0.976 . . . . 0.0 111.685 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.8 t70 -70.81 114.46 26.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.194 0.598 . . . . 0.0 110.405 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.08 -30.52 65.83 Favored 'Trans proline' 0 C--N 1.382 2.299 0 C-N-CA 122.735 2.29 . . . . 0.0 113.24 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.5 t -68.66 -43.13 76.87 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.746 0.419 . . . . 0.0 110.114 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -32.09 70.92 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.524 1.129 . . . . 0.0 110.662 -179.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.5 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 mt -70.42 -48.72 54.75 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.587 178.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -55.43 -47.01 76.63 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.838 173.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.33 -28.48 67.19 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.553 0.741 . . . . 0.0 111.932 -173.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -68.98 -46.68 67.46 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 123.541 0.526 . . . . 0.0 110.831 172.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.541 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.0 mm? -61.68 -31.54 71.68 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.717 0.807 . . . . 0.0 110.632 175.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -74.52 -38.36 62.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.8 0.84 . . . . 0.0 110.758 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.15 -33.11 69.74 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.62 0.768 . . . . 0.0 111.036 -178.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.1 p -91.03 2.2 56.5 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.936 0.894 . . . . 0.0 111.474 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 66.8 t30 63.21 16.79 9.69 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.657 1.183 . . . . 0.0 111.946 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 125.92 -25.45 5.54 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.395 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -74.86 106.86 6.59 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.306 0.553 . . . . 0.0 110.536 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.457 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.8 tt -68.89 -27.9 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.055 0.542 . . . . 0.0 112.079 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -66.66 -46.33 76.05 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.469 0.707 . . . . 0.0 110.637 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.429 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.5 mm-40 -62.52 -37.28 85.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.612 173.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.66 87.87 Favored 'General case' 0 C--O 1.244 0.763 0 C-N-CA 123.523 0.729 . . . . 0.0 111.001 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.1 t -60.8 -51.24 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 123.709 0.631 . . . . 0.0 110.165 174.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -55.04 -39.32 69.02 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 124.386 1.054 . . . . 0.0 111.538 -177.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 91.8 mt -73.4 -37.07 66.07 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.399 -178.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.717 HD13 HD12 ' A' ' 34' ' ' ILE . 50.0 mt -74.11 -33.36 63.56 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 120.55 0.214 . . . . 0.0 111.484 177.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.4 p . . . . . 0 CA--C 1.546 0.796 0 C-N-CA 123.096 0.558 . . . . 0.0 111.175 -179.603 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 C--O 1.243 0.738 0 CA-C-O 119.364 -0.35 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -29.04 64.94 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.07 0.395 . . . . 0.0 111.0 -177.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -64.19 -52.68 57.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.025 0.53 . . . . 0.0 110.468 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.01 -23.22 61.36 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.156 0.91 . . . . 0.0 111.4 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.38 -52.98 21.88 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.939 0.496 . . . . 0.0 111.025 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.8 mm -64.01 -43.23 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.718 0.807 . . . . 0.0 109.611 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.74 -41.71 95.91 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.03 0.932 . . . . 0.0 110.911 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 tt -66.16 -44.82 82.99 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.861 0.865 . . . . 0.0 110.213 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -64.39 -34.4 78.08 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.489 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.1 mm? . . . . . 0 CA--C 1.549 0.925 0 C-N-CA 123.203 0.601 . . . . 0.0 110.869 178.33 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.59 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.5 pt? -70.48 -38.16 74.35 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.659 0.784 . . . . 0.0 111.926 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.59 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.0 mm? -65.67 -53.19 44.54 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.824 0.449 . . . . 0.0 110.072 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -65.05 -41.41 95.19 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.968 1.418 . . . . 0.0 111.66 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -57.83 -51.49 69.38 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.802 0.441 . . . . 0.0 110.125 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.455 HD22 ' CD2' ' A' ' 44' ' ' LEU . 14.4 tp -63.08 -37.32 86.72 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 123.697 0.623 . . . . 0.0 110.821 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 20.2 ttp180 -63.02 -39.34 94.46 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.147 0.979 . . . . 0.0 110.62 -176.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.56 -20.18 34.27 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.422 -177.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.454 HG12 ' HA ' ' A' ' 28' ' ' LEU . 17.1 pt -99.4 -8.32 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 176.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.476 HG21 HD12 ' A' ' 58' ' ' LEU . 69.2 p -108.54 -48.12 3.38 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.06 0.544 . . . . 0.0 110.675 174.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.84 -16.44 28.24 Favored Glycine 0 N--CA 1.467 0.74 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.81 -175.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.678 HD12 HD13 ' A' ' 58' ' ' LEU . 57.0 mt -72.68 107.23 3.26 Favored 'Isoleucine or valine' 0 C--N 1.357 0.91 0 C-N-CA 124.039 0.935 . . . . 0.0 110.238 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -78.77 -1.69 35.95 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.025 0.93 . . . . 0.0 111.793 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -88.21 104.49 7.09 Favored Pre-proline 0 N--CA 1.474 0.751 0 C-N-CA 123.955 0.902 . . . . 0.0 109.656 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.509 ' HA ' HD12 ' A' ' 40' ' ' LEU . 37.3 Cg_endo -63.16 -25.42 72.72 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.069 2.513 . . . . 0.0 113.027 -176.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -60.44 -43.7 96.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.591 0.757 . . . . 0.0 111.631 178.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.418 ' CD2' HD13 ' A' ' 34' ' ' ILE . 0.7 OUTLIER -70.87 -29.47 65.58 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 123.307 0.643 . . . . 0.0 110.432 -178.384 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 37' ' ' PRO . 32.9 mt -72.58 -37.02 68.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.437 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -62.3 -44.3 96.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.202 0.601 . . . . 0.0 110.764 172.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.513 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.0 mt-10 -60.88 -39.79 90.55 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.564 0.746 . . . . 0.0 111.657 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.63 -44.51 77.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 123.648 0.592 . . . . 0.0 111.245 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.503 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -69.14 -26.01 64.66 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.139 0.976 . . . . 0.0 111.162 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 1.9 tmmm? -77.13 -42.71 36.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.791 0.837 . . . . 0.0 109.677 177.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.27 -36.36 77.03 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.573 0.749 . . . . 0.0 110.406 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 97.7 p -87.79 -5.25 58.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.531 0.732 . . . . 0.0 111.323 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.9 m120 64.68 24.02 12.87 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.545 1.138 . . . . 0.0 112.106 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.49 -2.88 30.87 Favored Glycine 0 C--N 1.347 1.143 0 CA-C-N 115.959 -0.564 . . . . 0.0 113.203 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -86.15 100.25 12.08 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.2 tt -66.62 -24.82 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.141 0.576 . . . . 0.0 112.146 -172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.8 m -67.93 -45.76 73.4 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.507 0.723 . . . . 0.0 110.191 176.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -70.22 -29.97 66.93 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.875 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.9 -51.48 61.72 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 123.442 0.697 . . . . 0.0 111.375 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.25 -38.96 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.022 177.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -54.29 -47.54 72.26 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 124.355 1.035 . . . . 0.0 110.297 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 92.0 mt -63.21 -45.28 92.38 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 123.759 0.662 . . . . 0.0 111.311 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.678 HD13 HD12 ' A' ' 34' ' ' ILE . 84.6 mt -71.06 -15.48 62.54 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.583 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 68.0 p . . . . . 0 N--CA 1.49 1.563 0 C-N-CA 122.986 0.514 . . . . 0.0 112.216 176.344 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.72 60.95 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.115 0.416 . . . . 0.0 111.436 -177.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.61 -42.75 88.87 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 170.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.29 -38.9 78.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.94 0.896 . . . . 0.0 110.726 -178.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.31 84.19 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.182 0.926 . . . . 0.0 111.397 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.14 -46.21 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.42 0.688 . . . . 0.0 110.195 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.48 81.09 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.656 0.782 . . . . 0.0 111.216 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.1 tp -66.46 -52.14 49.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.479 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.8 m -68.35 -26.47 65.61 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -172.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 N--CA 1.479 0.985 0 C-N-CA 122.651 0.38 . . . . 0.0 111.216 -179.767 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.3 tmm? . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 119.69 -0.195 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.612 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.2 pt? -56.39 -35.59 67.92 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.463 0.705 . . . . 0.0 111.886 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.612 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -61.74 -62.81 1.54 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.33 0.652 . . . . 0.0 109.632 178.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.48 -43.12 95.16 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 124.813 1.321 . . . . 0.0 111.401 -171.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.463 ' O ' HG12 ' A' ' 31' ' ' ILE . 7.1 mm100 -66.07 -52.12 51.77 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.748 -178.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 40' ' ' LEU . 20.6 tp -62.5 -44.66 95.83 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -57.98 -31.33 66.8 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.666 1.186 . . . . 0.0 111.77 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -71.77 -52.2 18.84 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.313 0.645 . . . . 0.0 110.496 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 27' ' ' GLN . 15.1 pt -89.65 3.45 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 p -114.41 -51.25 2.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 167.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.53 -2.05 34.47 Favored Glycine 0 C--N 1.341 0.844 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.836 -175.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.532 HD12 HD13 ' A' ' 58' ' ' LEU . 81.7 mt -82.21 120.68 34.15 Favored 'Isoleucine or valine' 0 C--N 1.351 0.67 0 C-N-CA 123.579 0.751 . . . . 0.0 110.58 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -79.98 -26.27 40.01 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.39 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 7.4 m-20 -64.24 110.69 4.21 Favored Pre-proline 0 N--CA 1.479 1.012 0 C-N-CA 124.668 1.187 . . . . 0.0 111.225 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.21 -26.23 57.06 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.833 2.355 . . . . 0.0 112.378 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 m -58.16 -52.14 66.78 Favored 'General case' 0 C--N 1.356 0.87 0 C-N-CA 123.739 0.816 . . . . 0.0 110.113 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -57.35 -37.59 72.8 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.274 0.984 . . . . 0.0 110.991 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.599 ' HA ' HD23 ' A' ' 28' ' ' LEU . 58.7 mt -70.7 -48.48 54.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 124.172 0.92 . . . . 0.0 111.486 -174.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -68.71 -38.91 80.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.929 0.492 . . . . 0.0 111.23 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.4 mt-10 -68.1 -37.25 80.98 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.226 0.61 . . . . 0.0 111.754 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.43 -43.81 72.62 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.797 0.686 . . . . 0.0 110.685 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.523 ' HG ' ' HB2' ' A' ' 24' ' ' LEU . 3.4 mm? -62.84 -35.74 80.93 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.96 0.904 . . . . 0.0 111.03 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.2 tmmm? -68.19 -47.1 68.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.708 0.803 . . . . 0.0 110.464 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.09 -19.89 61.06 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.771 0.828 . . . . 0.0 111.74 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.6 p -96.67 -0.71 48.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.455 0.702 . . . . 0.0 111.292 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 64.51 21.9 12.56 Favored 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 124.761 1.225 . . . . 0.0 111.089 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -16.18 24.98 Favored Glycine 0 C--N 1.348 1.225 0 CA-C-N 115.978 -0.555 . . . . 0.0 113.306 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -76.97 102.35 6.38 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-N 117.328 0.564 . . . . 0.0 110.459 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.9 tt -60.24 -25.72 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.665 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 29.0 m -67.86 -47.78 67.94 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.15 0.58 . . . . 0.0 110.709 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.434 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 7.9 mm-40 -65.47 -34.73 78.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.543 0.337 . . . . 0.0 110.657 175.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.16 -42.34 90.5 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.362 0.665 . . . . 0.0 110.885 178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.24 -52.15 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 123.798 0.686 . . . . 0.0 109.723 171.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.4 m -56.76 -33.26 66.42 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.126 0.892 . . . . 0.0 112.434 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -79.7 -36.17 37.96 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.567 0.747 . . . . 0.0 111.177 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -76.0 -25.2 55.54 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 175.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.5 p . . . . . 0 N--CA 1.472 0.661 0 C-N-CA 123.42 0.688 . . . . 0.0 111.426 179.369 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 N--CA 1.475 0.792 0 CA-C-O 120.865 0.365 . . . . 0.0 111.409 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -22.96 61.4 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.509 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -58.84 -47.07 86.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -34.76 72.91 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.19 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.05 77.33 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.474 0.71 . . . . 0.0 111.735 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.99 -41.36 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 123.568 0.747 . . . . 0.0 110.484 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.84 -51.8 66.76 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.663 0.602 . . . . 0.0 110.489 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 34.6 tp -61.33 -40.4 94.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.324 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -59.6 -40.02 86.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.487 0.715 . . . . 0.0 111.469 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.9 tt . . . . . 0 N--CA 1.477 0.877 0 C-N-CA 123.576 0.751 . . . . 0.0 109.645 178.412 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.528 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.2 pt? -59.17 -39.49 82.66 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.648 0.779 . . . . 0.0 112.737 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -70.54 -37.63 74.08 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.328 0.251 . . . . 0.0 110.371 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.85 -45.26 90.28 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.259 0.975 . . . . 0.0 110.211 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -62.24 -51.32 68.23 Favored 'General case' 0 C--N 1.349 0.564 0 O-C-N 124.422 1.077 . . . . 0.0 110.822 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' A' ' 40' ' ' LEU . 14.7 tp -63.79 -44.21 94.01 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.891 0.745 . . . . 0.0 110.629 -176.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttt-85 -54.25 -41.81 69.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.274 1.03 . . . . 0.0 110.933 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.1 -34.69 61.76 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.449 -174.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.06 -9.08 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.3 p -102.37 -53.51 2.88 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 171.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.49 -11.44 25.94 Favored Glycine 0 N--CA 1.47 0.911 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.243 -172.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.477 HD12 HD13 ' A' ' 58' ' ' LEU . 78.9 mt -73.95 118.82 20.06 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 110.151 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -85.04 -22.5 28.98 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.963 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -62.39 111.87 5.45 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.866 0.866 . . . . 0.0 110.688 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -62.47 -32.75 80.36 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 122.894 2.396 . . . . 0.0 112.509 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.2 m -54.47 -50.8 66.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.638 0.775 . . . . 0.0 110.79 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -57.0 -37.84 72.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.233 1.013 . . . . 0.0 111.146 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.615 ' HA ' HD23 ' A' ' 28' ' ' LEU . 40.5 mt -72.63 -50.85 22.43 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.777 -1.102 . . . . 0.0 111.293 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -60.74 -44.97 96.02 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.477 0.711 . . . . 0.0 111.205 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.406 ' HA ' ' HG2' ' A' ' 45' ' ' LYS . 44.0 mt-10 -66.02 -36.5 83.42 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.014 0.926 . . . . 0.0 112.086 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.8 -41.94 70.95 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.125 0.265 . . . . 0.0 110.423 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HG ' HD12 ' A' ' 24' ' ' LEU . 2.4 mm? -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.945 0.898 . . . . 0.0 110.59 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HG2' ' HA ' ' A' ' 42' ' ' GLU . 54.6 pttt -77.29 -32.23 55.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.549 0.339 . . . . 0.0 110.506 -174.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.67 -24.98 60.05 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.013 0.525 . . . . 0.0 111.187 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.416 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 88.4 p -93.26 3.28 55.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.771 0.828 . . . . 0.0 111.217 175.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 t30 72.04 7.2 5.75 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.348 1.459 . . . . 0.0 112.041 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 21.47 4.51 Favored Glycine 0 N--CA 1.473 1.148 0 C-N-CA 123.578 0.609 . . . . 0.0 112.106 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -104.38 116.5 32.24 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.402 0.681 . . . . 0.0 109.462 -174.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 7.8 tp -65.39 -32.88 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.154 0.582 . . . . 0.0 111.888 -175.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -75.52 -41.66 54.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.697 0.799 . . . . 0.0 111.379 -175.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.416 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 16.1 mm100 -75.1 -27.65 59.94 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.351 -0.218 . . . . 0.0 110.59 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.29 71.0 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.227 0.611 . . . . 0.0 111.256 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.84 -34.4 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.713 0.405 . . . . 0.0 109.998 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.0 t -63.5 -39.2 93.82 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 123.806 0.691 . . . . 0.0 111.524 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.25 -31.92 66.22 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.689 . . . . 0.0 111.518 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.477 HD13 HD12 ' A' ' 34' ' ' ILE . 57.7 mt -81.84 -26.8 33.96 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p . . . . . 0 N--CA 1.482 1.134 0 CA-C-N 117.987 0.358 . . . . 0.0 110.968 175.626 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -34.28 76.99 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.164 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -62.42 -39.38 93.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.596 0.758 . . . . 0.0 110.577 175.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.66 -42.46 67.5 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.253 0.971 . . . . 0.0 110.747 -175.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.43 -45.57 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.988 0.805 . . . . 0.0 111.295 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.8 mm -65.42 -46.24 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.321 0.649 . . . . 0.0 110.467 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.8 78.34 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.539 0.735 . . . . 0.0 111.224 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.98 -47.41 74.63 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -69.26 -24.46 63.98 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -177.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.48 1.047 0 C-N-CA 123.187 0.595 . . . . 0.0 111.429 -179.395 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 51.7 ttm . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.0 pt? -57.05 -34.98 68.8 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.738 0.815 . . . . 0.0 112.08 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -64.76 -51.88 59.97 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.859 0.464 . . . . 0.0 110.069 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -62.47 -49.86 73.74 Favored 'General case' 0 N--CA 1.484 1.229 0 O-C-N 124.688 1.242 . . . . 0.0 110.498 -174.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -55.24 -54.96 36.78 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.793 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' A' ' 40' ' ' LEU . 14.6 tp -70.73 -40.78 72.56 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 123.342 0.401 . . . . 0.0 111.024 -175.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -54.91 -38.05 67.13 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.179 0.992 . . . . 0.0 111.272 176.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -75.71 -42.07 51.81 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.877 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 28' ' ' LEU . 27.7 pt -86.23 -10.15 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.454 HG22 HG23 ' A' ' 55' ' ' VAL . 77.6 p -103.77 -50.84 3.31 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.428 0.632 . . . . 0.0 109.868 173.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.52 -4.61 32.9 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.541 -174.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.538 HD12 HD13 ' A' ' 58' ' ' LEU . 73.8 mt -81.0 118.8 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 124.263 1.025 . . . . 0.0 110.4 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -84.12 -18.65 36.13 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.054 -178.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 13.9 t70 -69.06 119.61 71.09 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.53 0.732 . . . . 0.0 110.27 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -69.29 -29.58 25.9 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.766 2.311 . . . . 0.0 113.287 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -63.34 -48.72 76.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.086 0.554 . . . . 0.0 110.242 -176.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -55.46 -38.62 69.31 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 124.257 0.973 . . . . 0.0 111.454 177.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.591 ' HA ' HD23 ' A' ' 28' ' ' LEU . 45.5 mt -69.57 -46.87 65.38 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.872 0.733 . . . . 0.0 110.89 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.12 -43.39 98.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.191 0.596 . . . . 0.0 111.267 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.516 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 49.2 mt-10 -70.75 -30.39 66.89 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.612 0.765 . . . . 0.0 111.833 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.58 -42.99 60.86 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 123.379 0.424 . . . . 0.0 110.347 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.463 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -66.19 -29.8 70.15 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.826 0.85 . . . . 0.0 110.21 176.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.3 tmmm? -75.21 -43.28 52.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 110.48 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.15 77.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.331 0.652 . . . . 0.0 110.738 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.9 p -88.53 -6.74 57.4 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.46 0.704 . . . . 0.0 111.405 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 66.48 13.18 9.15 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.083 1.353 . . . . 0.0 111.825 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.01 -14.79 5.42 Favored Glycine 0 C--N 1.351 1.394 0 CA-C-O 119.744 -0.476 . . . . 0.0 113.489 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -78.27 102.49 7.67 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.197 0.499 . . . . 0.0 109.935 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.1 tt -65.04 -27.01 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.5 m -68.26 -41.94 80.34 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 121.428 0.633 . . . . 0.0 110.348 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -72.27 -33.24 67.32 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.4 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.98 -51.05 70.88 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.541 0.736 . . . . 0.0 111.386 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.454 HG23 HG22 ' A' ' 32' ' ' THR . 7.7 p -64.01 -39.81 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.195 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.2 t -60.23 -33.22 71.96 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.525 0.516 . . . . 0.0 111.905 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 99.3 mt -77.93 -36.28 49.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.001 0.52 . . . . 0.0 111.522 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.538 HD13 HD12 ' A' ' 34' ' ' ILE . 73.2 mt -78.32 -18.44 55.19 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.6 p . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 123.205 0.602 . . . . 0.0 111.008 176.875 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -30.52 69.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.225 0.61 . . . . 0.0 112.053 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -65.62 -48.24 72.92 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.028 0.531 . . . . 0.0 110.158 179.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.04 70.35 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.626 0.579 . . . . 0.0 111.12 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -56.16 20.05 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.085 0.554 . . . . 0.0 111.013 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -72.8 -41.92 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.324 0.65 . . . . 0.0 110.673 -175.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.35 96.15 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.944 0.498 . . . . 0.0 111.554 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.5 tp -63.6 -46.68 84.7 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -59.37 -24.73 63.65 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.17 0.588 . . . . 0.0 112.406 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 C--O 1.244 0.789 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.179 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.7 ttt . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.574 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -56.67 -38.86 72.79 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.728 0.811 . . . . 0.0 112.27 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.574 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -65.3 -46.11 81.71 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -63.23 -44.74 94.39 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 124.418 1.074 . . . . 0.0 111.271 -177.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -55.55 33.4 Favored 'General case' 0 C--N 1.349 0.55 0 O-C-N 124.532 1.145 . . . . 0.0 110.075 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 40' ' ' LEU . 13.8 tp -66.61 -44.9 80.86 Favored 'General case' 0 C--N 1.351 0.665 0 O-C-N 124.213 0.946 . . . . 0.0 111.125 -174.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -56.93 -38.8 73.39 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.419 1.088 . . . . 0.0 111.605 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -71.62 -49.62 38.46 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.753 0.658 . . . . 0.0 110.641 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.488 HD11 HD12 ' A' ' 28' ' ' LEU . 14.6 pt -74.93 -30.21 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.3 p -87.2 -48.21 8.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.892 0.477 . . . . 0.0 110.152 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.37 4.92 54.82 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.665 -174.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.64 HD12 HD13 ' A' ' 58' ' ' LEU . 72.7 mt -84.85 124.8 40.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.865 0.866 . . . . 0.0 110.463 -177.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -90.21 -12.25 38.61 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.247 1.019 . . . . 0.0 112.61 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 8.0 m-20 -72.05 109.09 5.03 Favored Pre-proline 0 N--CA 1.475 0.816 0 O-C-N 123.787 0.68 . . . . 0.0 109.688 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -63.73 -28.64 68.64 Favored 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.0 2.466 . . . . 0.0 111.413 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.3 m -58.28 -51.98 67.49 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.118 0.967 . . . . 0.0 110.537 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -60.05 -34.42 73.38 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.718 0.807 . . . . 0.0 111.263 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.682 ' HA ' HD23 ' A' ' 28' ' ' LEU . 51.9 mt -69.88 -52.38 25.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.778 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -57.04 -49.84 74.6 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.751 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.4 -38.91 91.47 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.387 0.675 . . . . 0.0 112.373 -173.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.62 -42.2 82.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.462 0.476 . . . . 0.0 110.809 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.433 HD23 HD22 ' A' ' 28' ' ' LEU . 3.7 mm? -63.76 -32.8 74.42 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.856 0.862 . . . . 0.0 111.31 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 mpmm? -75.75 -41.61 52.76 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.836 0.454 . . . . 0.0 110.461 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.29 -27.28 67.04 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.07 0.948 . . . . 0.0 111.14 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -101.83 -1.63 31.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.792 0.837 . . . . 0.0 111.705 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 m120 64.68 16.97 10.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.964 1.306 . . . . 0.0 112.283 178.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.76 -13.57 13.1 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-O 119.51 -0.605 . . . . 0.0 113.126 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.4 109.05 5.14 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 109.773 -178.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.76 -28.94 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.591 0.756 . . . . 0.0 111.601 -172.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.7 m -71.85 -45.34 61.75 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.092 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.413 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.8 mm-40 -65.45 -40.44 93.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.876 0.471 . . . . 0.0 110.158 174.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.1 75.35 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.008 0.923 . . . . 0.0 111.869 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.2 p -64.73 -39.31 85.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.661 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.533 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.8 m -62.34 -36.55 82.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.384 0.673 . . . . 0.0 112.242 178.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.4 mt -71.64 -33.81 69.24 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.448 0.699 . . . . 0.0 111.007 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.64 HD13 HD12 ' A' ' 34' ' ' ILE . 79.6 mt -84.08 -26.68 28.82 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 176.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.8 p . . . . . 0 N--CA 1.483 1.197 0 C-N-CA 123.098 0.559 . . . . 0.0 110.799 178.785 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.7 t70 . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 120.334 0.112 . . . . 0.0 111.052 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.428 ' H ' HD13 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -66.47 -32.46 73.84 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.297 0.998 . . . . 0.0 111.704 -178.292 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -58.7 -57.32 13.54 Favored 'General case' 0 C--N 1.359 0.99 0 O-C-N 123.877 0.736 . . . . 0.0 110.368 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.82 -25.44 61.14 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.45 1.094 . . . . 0.0 111.386 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.81 -57.96 8.28 Favored 'General case' 0 C--N 1.354 0.779 0 C-N-CA 123.135 0.574 . . . . 0.0 110.156 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.26 -39.89 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -54.6 -59.1 5.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.021 0.928 . . . . 0.0 110.82 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 43.9 tp -67.73 -34.39 76.75 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.119 0.887 . . . . 0.0 111.398 -177.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.1 t -66.4 -30.16 70.48 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 122.381 0.272 . . . . 0.0 111.443 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 43.3 mt . . . . . 0 CA--C 1.549 0.93 0 C-N-CA 123.769 0.828 . . . . 0.0 110.96 175.436 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.0 tpt . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.507 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.5 pt? -62.54 -33.54 75.13 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.995 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.2 -49.45 71.95 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.164 0.586 . . . . 0.0 109.938 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -69.3 -42.33 75.59 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.73 -174.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -56.26 -54.34 46.49 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.364 1.065 . . . . 0.0 110.727 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.521 HD23 ' HA ' ' A' ' 40' ' ' LEU . 15.2 tp -65.08 -42.2 94.34 Favored 'General case' 0 C--N 1.357 0.922 0 O-C-N 123.496 0.498 . . . . 0.0 111.285 -177.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -57.29 -37.63 72.71 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.209 1.004 . . . . 0.0 111.4 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.45 -48.37 56.27 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.336 0.654 . . . . 0.0 111.161 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 17.7 pt -82.51 -16.18 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 74.9 p -96.05 -48.01 5.86 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.111 0.481 . . . . 0.0 109.874 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -9.87 47.33 Favored Glycine 0 N--CA 1.468 0.816 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.026 -173.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.422 HD12 ' HB3' ' A' ' 58' ' ' LEU . 88.1 mt -75.85 112.11 13.11 Favored 'Isoleucine or valine' 0 C--N 1.348 0.538 0 C-N-CA 124.202 1.001 . . . . 0.0 110.351 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -79.49 -14.92 58.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 9.4 t70 -78.17 116.33 58.03 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.07 0.948 . . . . 0.0 110.336 -175.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.01 -23.43 34.21 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.924 2.416 . . . . 0.0 113.456 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.0 m -62.31 -50.15 72.77 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.073 0.549 . . . . 0.0 110.061 -177.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.8 -38.36 78.42 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 125.112 1.507 . . . . 0.0 111.318 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 28' ' ' LEU . 43.1 mt -67.67 -46.55 72.03 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.199 0.937 . . . . 0.0 111.111 -176.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -62.27 -46.06 90.49 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.667 0.604 . . . . 0.0 111.022 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.509 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 47.2 mt-10 -65.15 -31.2 72.27 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.497 0.719 . . . . 0.0 112.16 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -43.81 64.58 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.676 0.61 . . . . 0.0 110.43 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.507 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.2 mm? -68.58 -27.05 65.72 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 0.0 110.349 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.7 tmmm? -75.38 -45.2 40.62 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.255 1.022 . . . . 0.0 110.309 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.22 -30.29 68.42 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.443 0.697 . . . . 0.0 111.274 -177.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.08 2.79 56.06 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.724 0.81 . . . . 0.0 112.123 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 67.65 11.74 8.52 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.842 1.257 . . . . 0.0 111.866 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.05 2.25 22.08 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 123.537 0.589 . . . . 0.0 113.55 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -88.17 110.26 20.55 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.352 0.596 . . . . 0.0 110.666 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.4 tt -67.99 -18.94 24.22 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.798 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 m -71.08 -50.55 32.54 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.456 0.703 . . . . 0.0 111.008 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.4 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 27.3 mm-40 -64.66 -38.64 91.69 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.903 174.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.68 62.59 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.127 0.892 . . . . 0.0 112.527 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -65.06 -41.15 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 O-C-N 123.583 0.552 . . . . 0.0 110.888 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.8 t -59.41 -42.7 92.4 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.612 0.57 . . . . 0.0 111.227 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 85.9 mt -71.18 -38.14 72.14 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.049 0.54 . . . . 0.0 111.559 -177.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.422 ' HB3' HD12 ' A' ' 34' ' ' ILE . 37.8 mt -76.78 -26.43 54.49 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.48 1.051 0 CA-C-N 118.163 0.438 . . . . 0.0 110.877 179.157 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -32.15 72.44 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.437 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -66.15 -44.85 82.94 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.94 0.496 . . . . 0.0 110.393 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.96 90.54 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.011 0.819 . . . . 0.0 110.677 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -57.76 11.33 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.206 1.003 . . . . 0.0 111.83 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.2 mm -64.47 -42.18 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.926 0.891 . . . . 0.0 111.188 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.78 88.65 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.342 0.657 . . . . 0.0 111.528 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.01 -45.65 80.77 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -67.69 -27.78 67.12 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.614 0.765 . . . . 0.0 111.908 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.9 tt . . . . . 0 N--CA 1.477 0.884 0 C-N-CA 123.85 0.86 . . . . 0.0 109.889 -177.356 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.1 ttt . . . . . 0 N--CA 1.482 1.161 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.592 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -52.48 -39.86 61.68 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.466 0.707 . . . . 0.0 112.605 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.592 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.1 mm? -62.55 -51.99 65.18 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -60.14 -46.28 90.18 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.553 1.158 . . . . 0.0 111.809 -174.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -62.26 -55.86 24.24 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 124.138 0.899 . . . . 0.0 110.596 -178.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -62.38 -49.44 75.54 Favored 'General case' 0 C--N 1.356 0.865 0 O-C-N 123.806 0.691 . . . . 0.0 111.019 -176.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -57.27 -34.4 68.61 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.648 1.179 . . . . 0.0 111.493 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.76 -54.07 26.57 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.558 175.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.0 pt -88.5 -6.47 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -167.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 p -105.49 -40.11 5.9 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.306 0.643 . . . . 0.0 109.535 171.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.72 1.8 67.78 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.982 -176.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.573 HD12 HD13 ' A' ' 58' ' ' LEU . 67.1 mt -78.98 122.21 33.74 Favored 'Isoleucine or valine' 0 C--N 1.348 0.516 0 C-N-CA 123.939 0.896 . . . . 0.0 111.262 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -83.05 -21.0 33.92 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.985 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 10.5 m-20 -66.87 109.13 3.03 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 123.793 0.837 . . . . 0.0 110.061 -177.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -69.17 -29.54 26.51 Favored 'Trans proline' 0 C--N 1.373 1.85 0 C-N-CA 122.512 2.142 . . . . 0.0 111.763 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 m -61.4 -43.07 99.5 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.284 0.634 . . . . 0.0 109.909 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -60.73 -39.15 87.58 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 123.404 0.44 . . . . 0.0 110.36 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.613 ' HA ' HD23 ' A' ' 28' ' ' LEU . 62.0 mt -67.72 -52.85 32.82 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 124.19 0.931 . . . . 0.0 111.499 -175.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -62.36 -49.73 74.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.697 0.399 . . . . 0.0 111.54 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -65.33 -26.77 68.19 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.978 0.511 . . . . 0.0 111.878 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.23 -45.24 70.28 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.618 0.367 . . . . 0.0 110.502 171.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.468 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -66.31 -23.15 66.33 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.555 0.742 . . . . 0.0 111.091 175.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mpmm? -75.62 -45.37 37.81 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.363 0.665 . . . . 0.0 109.425 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -12.88 61.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.861 0.864 . . . . 0.0 112.048 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 98.5 p -110.44 -4.68 15.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.366 0.667 . . . . 0.0 111.725 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 65.05 20.88 12.17 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.551 1.14 . . . . 0.0 112.08 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.88 2.57 32.08 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-O 119.543 -0.587 . . . . 0.0 113.318 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -89.42 115.63 27.01 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.009 0.523 . . . . 0.0 110.305 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.556 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.6 tp -62.38 -39.13 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.468 0.307 . . . . 0.0 111.774 -173.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.1 m -66.05 -47.66 73.64 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.795 0.838 . . . . 0.0 110.89 -172.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -65.44 -36.79 84.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.239 0.615 . . . . 0.0 110.858 177.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -44.75 87.06 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 123.586 0.554 . . . . 0.0 111.336 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 51' ' ' ILE . 38.9 t -62.1 -49.3 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.866 177.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 m -54.55 -45.84 73.52 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.136 0.974 . . . . 0.0 111.762 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -71.49 -34.19 69.92 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.124 -175.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.573 HD13 HD12 ' A' ' 34' ' ' ILE . 62.8 mt -72.77 -45.52 58.19 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 175.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.1 p . . . . . 0 N--CA 1.477 0.909 0 C-N-CA 123.481 0.713 . . . . 0.0 112.012 -178.364 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 . . . . . 0 N--CA 1.48 1.061 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.404 ' H ' HD13 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -72.9 -26.87 61.57 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.757 -178.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -64.68 -44.59 89.86 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.496 0.318 . . . . 0.0 110.323 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.39 91.45 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.665 0.603 . . . . 0.0 111.211 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.22 75.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.761 0.824 . . . . 0.0 111.965 -177.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 43.9 mm -68.39 -38.97 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 110.764 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.27 97.27 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.962 0.505 . . . . 0.0 111.187 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.82 -45.8 87.97 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.605 176.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.7 t -66.37 -26.9 67.48 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.044 0.937 . . . . 0.0 111.798 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 N--CA 1.478 0.944 0 C-N-CA 123.299 0.64 . . . . 0.0 109.799 -177.055 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.4 ptt? . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.556 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -59.15 -41.71 88.97 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.2 0.6 . . . . 0.0 112.178 177.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.556 HD22 ' HG ' ' A' ' 24' ' ' LEU . 2.7 mm? -72.78 -44.91 60.98 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.104 0.161 . . . . 0.0 110.657 177.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -59.27 -51.12 71.31 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 124.071 0.857 . . . . 0.0 111.124 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -66.37 -46.98 74.85 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.11 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.489 HD22 ' CD2' ' A' ' 44' ' ' LEU . 19.0 tp -56.19 -49.99 72.5 Favored 'General case' 0 C--N 1.368 1.382 0 O-C-N 123.647 0.592 . . . . 0.0 110.428 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.455 ' NH2' HE22 ' A' ' 35' ' ' GLN . 66.1 ttt180 -54.43 -40.44 68.33 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.797 1.239 . . . . 0.0 111.546 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.89 -46.74 73.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.917 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 pt -93.38 1.59 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -170.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.513 HG21 HD12 ' A' ' 58' ' ' LEU . 68.6 p -117.83 -41.11 2.94 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.089 0.556 . . . . 0.0 110.363 171.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.85 2.47 55.12 Favored Glycine 0 N--CA 1.469 0.89 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.006 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.674 HD12 HD13 ' A' ' 58' ' ' LEU . 67.6 mt -82.15 115.55 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 110.937 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.455 HE22 ' NH2' ' A' ' 29' ' ' ARG . 16.6 mm100 -79.65 -20.52 46.52 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.665 1.186 . . . . 0.0 111.793 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.99 108.02 3.26 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 123.517 0.727 . . . . 0.0 109.823 176.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.0 -27.2 50.45 Favored 'Trans proline' 0 C--N 1.385 2.46 0 C-N-CA 122.603 2.202 . . . . 0.0 111.137 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -58.05 -51.23 70.54 Favored 'General case' 0 C--N 1.352 0.717 0 C-N-CA 124.12 0.968 . . . . 0.0 111.19 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.51 ' CD2' HD13 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -62.49 -28.9 70.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.112 0.965 . . . . 0.0 110.664 -179.058 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.1 mt -73.2 -54.82 7.49 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.623 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -57.55 -38.09 74.17 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.397 0.679 . . . . 0.0 111.55 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -69.03 -37.04 78.38 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.535 0.734 . . . . 0.0 111.829 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.436 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -62.5 -47.77 82.49 Favored 'General case' 0 C--O 1.241 0.608 0 O-C-N 123.366 0.416 . . . . 0.0 110.868 172.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.1 mm? -64.67 -35.6 81.56 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.563 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -75.43 -36.53 60.77 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.89 -33.82 74.4 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.463 0.705 . . . . 0.0 110.616 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 m -91.1 3.14 55.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.295 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 65.55 12.05 7.91 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.141 1.377 . . . . 0.0 113.099 173.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.4 -11.56 7.16 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 119.518 -0.601 . . . . 0.0 112.624 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -79.64 108.24 13.02 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 117.401 0.601 . . . . 0.0 109.999 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.491 ' O ' HG23 ' A' ' 55' ' ' VAL . 16.2 tt -67.85 -31.34 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.969 -175.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 23.9 m -70.97 -43.39 68.18 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.039 0.536 . . . . 0.0 110.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.449 HE21 ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -68.04 -32.05 72.14 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.207 175.32 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.96 93.78 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.386 0.675 . . . . 0.0 110.978 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.0 t -60.81 -46.4 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 123.69 0.619 . . . . 0.0 109.698 174.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.6 m -55.82 -39.18 71.02 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.567 0.747 . . . . 0.0 112.158 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.75 -40.28 63.61 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.326 0.651 . . . . 0.0 111.741 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.674 HD13 HD12 ' A' ' 34' ' ' ILE . 88.6 mt -68.69 -46.29 69.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.528 0.331 . . . . 0.0 111.878 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.6 p . . . . . 0 N--CA 1.474 0.745 0 O-C-N 124.096 0.873 . . . . 0.0 111.198 -178.449 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 . . . . . 0 N--CA 1.488 1.464 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.401 HD13 ' H ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -68.54 -33.18 73.65 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.231 0.332 . . . . 0.0 110.337 179.097 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.401 ' H ' HD13 ' A' ' 102' ' ' LEU . 25.9 mm-40 -72.16 -29.54 64.13 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.642 0.777 . . . . 0.0 111.284 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.15 -44.83 59.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.799 0.84 . . . . 0.0 109.474 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.89 73.19 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.609 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.8 mm -71.04 -40.35 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.457 0.703 . . . . 0.0 111.193 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.7 -42.01 96.35 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.387 0.429 . . . . 0.0 110.617 176.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.36 -50.48 67.54 Favored 'General case' 0 C--N 1.353 0.745 0 O-C-N 123.815 0.697 . . . . 0.0 109.71 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -63.8 -29.85 71.0 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.556 0.742 . . . . 0.0 111.211 -178.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.9 tp . . . . . 0 N--CA 1.481 1.123 0 C-N-CA 123.934 0.894 . . . . 0.0 110.561 177.739 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.5 ttt . . . . . 0 N--CA 1.494 1.76 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.453 HD23 ' H ' ' A' ' 24' ' ' LEU . 1.8 pt? -51.83 -44.95 63.78 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.685 0.794 . . . . 0.0 111.85 175.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.43 -38.63 81.37 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.019 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.37 -53.72 44.25 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 123.634 0.584 . . . . 0.0 110.376 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -50.04 -56.46 10.67 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 124.516 1.135 . . . . 0.0 109.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.4 tp -57.7 -50.16 74.12 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 124.799 1.312 . . . . 0.0 111.166 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -57.26 -39.24 75.2 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.655 1.182 . . . . 0.0 112.489 -175.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.43 -37.02 52.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.303 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 pt -90.11 -14.11 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 80.2 p -102.96 -31.18 10.36 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.288 0.635 . . . . 0.0 110.409 173.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.11 -7.43 76.17 Favored Glycine 0 N--CA 1.47 0.917 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.963 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.514 HD12 HD13 ' A' ' 58' ' ' LEU . 84.6 mt -80.04 117.35 25.72 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 C-N-CA 124.004 0.921 . . . . 0.0 110.993 -173.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -82.35 -25.82 33.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.749 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 6.7 m-20 -58.92 109.35 1.81 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 124.081 0.952 . . . . 0.0 111.13 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.84 -23.13 48.22 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.113 2.542 . . . . 0.0 111.977 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.2 m -56.91 -52.13 66.39 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.971 0.908 . . . . 0.0 109.933 174.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.35 -38.51 91.45 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.784 0.834 . . . . 0.0 110.897 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.594 ' HA ' HD23 ' A' ' 28' ' ' LEU . 73.8 mt -69.63 -55.49 9.9 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.261 0.976 . . . . 0.0 111.437 -173.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -63.96 -42.41 97.29 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.252 0.621 . . . . 0.0 111.769 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 45.2 mt-10 -72.52 -29.41 63.57 Favored 'General case' 0 C--N 1.351 0.647 0 C-N-CA 122.876 0.47 . . . . 0.0 111.881 -176.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.15 74.7 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 117.838 0.29 . . . . 0.0 110.407 172.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.463 ' CD2' HD22 ' A' ' 28' ' ' LEU . 3.0 mm? -67.79 -32.72 73.48 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.794 0.838 . . . . 0.0 110.891 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.2 tmmm? -71.53 -44.9 63.77 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.921 0.888 . . . . 0.0 110.238 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.57 -30.47 67.18 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.729 0.812 . . . . 0.0 111.447 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.3 p -85.68 0.48 52.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.448 0.699 . . . . 0.0 112.135 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 64.5 25.75 13.3 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 122.08 0.943 . . . . 0.0 110.491 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.1 65.12 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.456 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -74.58 108.51 7.38 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.552 ' O ' HG23 ' A' ' 55' ' ' VAL . 7.0 tp -55.73 -44.68 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.478 0.486 . . . . 0.0 111.784 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.5 m -66.28 -39.37 89.35 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.842 0.857 . . . . 0.0 111.329 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.492 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 mm-40 -62.9 -43.32 99.12 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 122.976 0.51 . . . . 0.0 110.029 173.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.57 -41.08 93.88 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 124.082 0.864 . . . . 0.0 111.614 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -58.86 -49.86 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.299 173.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.1 t -61.75 -31.29 71.46 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.077 0.861 . . . . 0.0 111.788 -178.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.8 mt -73.24 -33.93 65.59 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.514 HD13 HD12 ' A' ' 34' ' ' ILE . 80.2 mt -89.3 -17.54 28.75 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.4 p . . . . . 0 N--CA 1.482 1.165 0 CA-C-N 118.046 0.384 . . . . 0.0 111.867 -178.09 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 120.836 0.351 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.435 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -59.9 -30.8 69.27 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.181 176.836 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -67.85 -45.17 75.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.135 0.974 . . . . 0.0 110.852 -176.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.45 -27.02 61.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.564 0.746 . . . . 0.0 110.903 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.03 81.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.434 0.694 . . . . 0.0 111.233 174.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' ' 102' ' ' LEU . 42.5 mm -64.53 -42.06 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.953 0.901 . . . . 0.0 109.793 175.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.74 91.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.935 0.894 . . . . 0.0 111.383 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.08 -44.56 84.11 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.7 0.8 . . . . 0.0 109.378 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t -66.49 -36.44 82.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.516 0.726 . . . . 0.0 112.193 -175.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 48.9 mt . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -171.978 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.5 pmm? . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.37 0.129 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.614 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -61.54 -40.93 96.44 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.345 1.058 . . . . 0.0 112.134 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.614 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -64.5 -51.38 63.25 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.929 0.892 . . . . 0.0 110.799 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -69.34 -44.09 72.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.294 1.038 . . . . 0.0 111.456 -172.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -64.64 -46.79 81.03 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.755 0.66 . . . . 0.0 110.949 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -61.39 -46.04 91.85 Favored 'General case' 0 C--N 1.363 1.188 0 O-C-N 123.552 0.533 . . . . 0.0 110.532 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -58.34 -36.95 74.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.782 0.833 . . . . 0.0 111.634 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.86 -45.54 64.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.015 0.526 . . . . 0.0 111.052 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.3 pt -83.22 -19.84 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.499 HG21 HD12 ' A' ' 58' ' ' LEU . 81.4 p -98.91 -40.73 7.94 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.267 0.627 . . . . 0.0 110.142 176.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.49 -3.23 57.74 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.131 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.713 HD12 HD13 ' A' ' 58' ' ' LEU . 61.6 mt -77.74 113.99 17.66 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 C-N-CA 123.588 0.755 . . . . 0.0 111.012 -172.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -81.26 -15.72 54.73 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.706 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.25 114.13 37.43 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -71.91 -15.86 29.45 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.776 2.317 . . . . 0.0 113.221 -176.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -67.17 -51.02 58.81 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -55.63 -34.74 65.18 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 124.031 0.832 . . . . 0.0 111.881 176.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.2 mt -68.35 -53.81 21.53 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 123.911 0.757 . . . . 0.0 110.428 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -58.8 -38.26 78.19 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.757 175.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -74.97 -29.29 60.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.027 0.531 . . . . 0.0 111.806 -176.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.3 77.43 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -76.42 -23.32 53.98 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.929 0.892 . . . . 0.0 110.073 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -70.45 -56.36 6.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.899 1.28 . . . . 0.0 110.44 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.71 69.36 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.974 0.91 . . . . 0.0 111.061 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.506 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 89.4 p -84.43 -5.75 59.31 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.516 0.726 . . . . 0.0 112.052 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 70.1 13.32 7.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.1 1.36 . . . . 0.0 112.025 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.08 42.84 1.59 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -132.4 115.52 15.68 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.501 0.72 . . . . 0.0 109.352 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.3 tt -74.13 -21.1 17.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.327 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 83.7 m -73.06 -49.81 26.51 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.221 0.608 . . . . 0.0 110.435 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 29.0 mm-40 -60.19 -40.38 89.82 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.785 172.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.82 -52.99 63.38 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.238 0.961 . . . . 0.0 112.263 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.452 HG23 HG22 ' A' ' 32' ' ' THR . 10.1 p -64.48 -36.0 76.04 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 C-N-CA 122.6 0.36 . . . . 0.0 110.446 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.7 t -63.03 -40.97 99.32 Favored 'General case' 0 CA--C 1.554 1.135 0 O-C-N 123.751 0.657 . . . . 0.0 111.27 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.56 -22.58 54.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.668 0.787 . . . . 0.0 111.648 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 HD12 ' A' ' 34' ' ' ILE . 82.5 mt -85.66 -29.21 24.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.529 0.331 . . . . 0.0 111.545 173.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.0 p . . . . . 0 N--CA 1.481 1.085 0 C-N-CA 122.5 0.32 . . . . 0.0 111.019 174.504 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.4 t70 . . . . . 0 N--CA 1.474 0.762 0 CA-C-O 120.748 0.309 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -23.58 61.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.503 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -63.19 -49.24 75.03 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 172.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.75 -38.09 85.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.652 0.595 . . . . 0.0 111.414 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.64 -49.37 68.91 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.79 0.836 . . . . 0.0 111.436 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.4 mm -67.48 -43.41 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.309 0.643 . . . . 0.0 110.467 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.83 -49.37 76.9 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 123.949 0.781 . . . . 0.0 111.143 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.38 -43.47 90.62 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.033 0.933 . . . . 0.0 109.604 -178.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.8 t -76.68 -14.08 59.99 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.115 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 tt . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 172.804 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.8 tpp . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.235 0.828 . . . . 0.0 113.235 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.664 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.8 pt? -59.3 -36.88 76.4 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.772 0.829 . . . . 0.0 112.718 -177.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.664 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -66.55 -46.93 74.47 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.123 0.569 . . . . 0.0 110.333 177.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -65.75 -42.55 90.78 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.251 0.97 . . . . 0.0 110.882 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -64.51 -52.58 57.07 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 124.328 1.018 . . . . 0.0 111.001 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 40' ' ' LEU . 22.2 tp -57.41 -46.97 82.92 Favored 'General case' 0 C--N 1.364 1.227 0 O-C-N 124.065 0.853 . . . . 0.0 110.264 178.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -53.96 -39.72 66.21 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.573 1.149 . . . . 0.0 111.769 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -72.55 -40.43 66.68 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.635 -176.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.0 pt -98.88 2.17 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 123.672 0.789 . . . . 0.0 112.584 -172.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.1 p -112.57 -42.49 3.64 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.307 0.643 . . . . 0.0 109.454 168.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.57 -13.87 38.97 Favored Glycine 0 N--CA 1.468 0.781 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.613 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.519 HD12 HD13 ' A' ' 58' ' ' LEU . 72.0 mt -75.16 110.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.35 0.602 0 C-N-CA 123.912 0.885 . . . . 0.0 110.332 -175.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -71.44 -32.73 68.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.057 0.943 . . . . 0.0 111.17 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -64.11 115.53 20.15 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 123.653 0.781 . . . . 0.0 111.53 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.474 ' HA ' HD12 ' A' ' 40' ' ' LEU . 42.2 Cg_endo -62.59 -22.62 74.19 Favored 'Trans proline' 0 C--N 1.391 2.812 0 C-N-CA 123.579 2.853 . . . . 0.0 112.97 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -54.43 -53.68 50.96 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.884 0.874 . . . . 0.0 110.976 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.89 -33.53 75.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.677 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.609 ' HA ' HD23 ' A' ' 28' ' ' LEU . 46.2 mt -72.28 -47.1 52.67 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 124.428 1.08 . . . . 0.0 111.038 -171.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -60.94 -54.42 45.28 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.709 0.63 . . . . 0.0 109.901 172.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.83 -30.15 68.75 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.876 0.735 . . . . 0.0 112.391 -174.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.34 -49.83 45.29 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 122.971 0.509 . . . . 0.0 110.317 174.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.505 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.4 mm? -59.04 -29.74 67.51 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.996 0.918 . . . . 0.0 111.246 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -71.65 -51.0 25.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.401 0.68 . . . . 0.0 109.794 174.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.73 62.59 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.713 0.805 . . . . 0.0 112.434 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -104.4 4.27 33.18 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.551 0.74 . . . . 0.0 112.374 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.6 t30 70.66 -2.63 2.18 Favored 'General case' 0 CA--C 1.571 1.751 0 C-N-CA 124.579 1.152 . . . . 0.0 111.582 -176.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.18 -6.95 10.79 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.777 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -79.28 105.95 10.97 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.006 0.523 . . . . 0.0 110.201 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.473 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.2 tt -65.24 -27.21 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 C-N-CA 122.914 0.485 . . . . 0.0 112.167 -173.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 36.3 m -66.01 -47.39 74.63 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 123.496 0.719 . . . . 0.0 110.685 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.425 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 21.1 mm-40 -60.9 -39.26 88.67 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.604 174.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.34 -41.54 89.42 Favored 'General case' 0 C--O 1.246 0.869 0 O-C-N 124.051 0.845 . . . . 0.0 111.856 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.3 t -59.18 -50.09 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 123.723 0.64 . . . . 0.0 109.71 173.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m -56.7 -41.74 77.91 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 124.307 1.004 . . . . 0.0 111.482 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -74.1 -29.85 62.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.684 0.794 . . . . 0.0 111.898 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.519 HD13 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -84.17 -32.53 24.55 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 177.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.7 p . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -173.833 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.477 0.913 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -22.91 53.6 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -61.1 -55.98 26.2 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 170.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.14 79.75 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.635 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.57 -56.17 8.08 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.398 0.679 . . . . 0.0 111.414 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.7 mm -64.22 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.226 0.61 . . . . 0.0 110.369 -178.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.25 -47.18 80.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.307 0.643 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.9 tp -65.82 -31.57 72.6 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 122.702 0.401 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.3 t -71.62 -33.61 69.11 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.548 0.739 . . . . 0.0 110.864 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 41.6 tp . . . . . 0 N--CA 1.477 0.901 0 C-N-CA 123.903 0.881 . . . . 0.0 111.022 -178.598 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.486 1.364 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.443 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.3 pt? -64.55 -39.57 94.0 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.481 0.713 . . . . 0.0 111.578 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.95 -48.16 69.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.688 0.795 . . . . 0.0 110.161 175.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -62.09 -49.9 74.08 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.618 1.199 . . . . 0.0 110.978 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.421 ' O ' HG12 ' A' ' 31' ' ' ILE . 7.9 mm100 -62.45 -56.33 19.2 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.462 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.513 HD22 HD23 ' A' ' 44' ' ' LEU . 20.5 tp -57.56 -45.26 85.37 Favored 'General case' 0 C--N 1.36 1.061 0 O-C-N 123.784 0.677 . . . . 0.0 110.685 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -55.6 -45.28 77.47 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.77 0.828 . . . . 0.0 111.243 176.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.25 -34.96 79.18 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.296 0.638 . . . . 0.0 111.29 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.8 pt -104.8 2.42 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -173.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.1 p -112.33 -50.48 2.9 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.511 0.672 . . . . 0.0 109.668 167.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.49 22.53 10.31 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.927 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.441 HD12 HD13 ' A' ' 58' ' ' LEU . 62.4 mt -101.59 122.76 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.242 0.617 . . . . 0.0 110.28 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -81.59 -26.45 34.91 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.174 0.99 . . . . 0.0 111.91 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.13 112.54 10.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.082 0.553 . . . . 0.0 110.525 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.89 -22.01 49.49 Favored 'Trans proline' 0 C--N 1.385 2.456 0 C-N-CA 122.906 2.404 . . . . 0.0 111.872 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -57.28 -52.25 66.1 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.233 0.958 . . . . 0.0 110.188 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -60.72 -40.84 93.79 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.193 0.933 . . . . 0.0 111.584 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.511 ' HA ' HD23 ' A' ' 28' ' ' LEU . 66.0 mt -68.15 -46.28 71.23 Favored 'General case' 0 C--O 1.246 0.887 0 O-C-N 124.083 0.864 . . . . 0.0 111.488 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 71.2 m-70 -64.96 -51.16 63.31 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.328 176.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -58.0 -33.08 68.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.285 0.634 . . . . 0.0 112.18 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.11 -48.88 61.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 123.747 0.654 . . . . 0.0 110.419 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.513 HD23 HD22 ' A' ' 28' ' ' LEU . 3.3 mm? -61.1 -29.64 69.88 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.903 0.881 . . . . 0.0 111.385 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -76.27 -48.19 21.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.793 0.837 . . . . 0.0 110.704 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.89 -35.3 80.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.784 0.834 . . . . 0.0 111.094 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.0 m -87.77 1.92 52.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.649 0.78 . . . . 0.0 111.571 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.457 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER 66.44 12.16 8.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.848 1.259 . . . . 0.0 112.6 174.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.57 -11.87 11.15 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-O 119.805 -0.442 . . . . 0.0 112.865 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -77.97 104.88 8.81 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 121.293 0.568 . . . . 0.0 110.483 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.503 ' O ' HG23 ' A' ' 55' ' ' VAL . 18.0 tt -64.04 -26.17 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.014 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.3 m -65.13 -52.77 53.26 Favored 'General case' 0 C--O 1.251 1.179 0 C-N-CA 123.685 0.794 . . . . 0.0 110.908 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.477 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 14.3 mm100 -62.15 -37.93 87.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.815 174.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.72 -44.36 81.53 Favored 'General case' 0 C--O 1.247 0.948 0 O-C-N 124.114 0.884 . . . . 0.0 111.848 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 51' ' ' ILE . 59.6 t -59.31 -50.36 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 122.918 0.487 . . . . 0.0 109.806 172.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m -56.99 -35.75 69.56 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.333 1.021 . . . . 0.0 112.169 -175.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 76.7 mt -72.89 -44.02 61.78 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.939 0.495 . . . . 0.0 110.395 178.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.441 HD13 HD12 ' A' ' 34' ' ' ILE . 58.6 mt -78.03 -10.15 59.47 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.4 p . . . . . 0 N--CA 1.473 0.711 0 C-N-CA 122.86 0.464 . . . . 0.0 110.825 175.993 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 111.614 0.228 . . . . 0.0 111.614 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.39 -32.35 68.35 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.463 0.705 . . . . 0.0 110.381 -178.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -66.71 -44.64 81.11 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.97 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.22 -35.17 79.03 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 124.104 0.878 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.39 8.37 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.675 0.79 . . . . 0.0 111.073 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.0 mm -61.6 -46.06 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.112 0.965 . . . . 0.0 110.966 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.32 82.31 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.131 0.895 . . . . 0.0 111.149 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -49.44 77.79 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.746 0.654 . . . . 0.0 109.432 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 45.2 m -59.38 -38.24 79.98 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.964 0.79 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.0 mt . . . . . 0 CA--C 1.547 0.856 0 C-N-CA 123.531 0.733 . . . . 0.0 111.812 -179.255 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.5 ttm . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.494 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -51.57 -41.28 61.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.035 0.934 . . . . 0.0 112.605 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.494 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.5 mm? -62.99 -52.36 63.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.679 0.792 . . . . 0.0 109.961 176.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -67.37 -39.97 85.72 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 124.218 0.949 . . . . 0.0 111.723 -172.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.442 ' O ' HG12 ' A' ' 31' ' ' ILE . 18.7 mm100 -65.52 -50.42 65.32 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.488 0.715 . . . . 0.0 110.218 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.586 HD23 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -61.55 -45.09 95.65 Favored 'General case' 0 C--N 1.357 0.919 0 O-C-N 123.878 0.737 . . . . 0.0 110.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -56.77 -37.78 71.55 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.595 1.158 . . . . 0.0 111.746 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.59 -51.08 64.59 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.893 0.877 . . . . 0.0 110.496 177.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 27' ' ' GLN . 5.8 pt -96.48 2.38 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -169.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.462 HG21 HD12 ' A' ' 58' ' ' LEU . 73.1 p -110.55 -37.97 5.32 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 167.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.4 -9.07 58.99 Favored Glycine 0 C--N 1.342 0.913 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.012 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.597 HD12 HD13 ' A' ' 58' ' ' LEU . 64.9 mt -79.58 112.17 17.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.491 0 C-N-CA 123.641 0.776 . . . . 0.0 110.409 -174.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -73.11 -29.21 62.75 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.717 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 20.0 t70 -63.09 115.33 16.76 Favored Pre-proline 0 C--N 1.35 0.611 0 C-N-CA 124.0 0.92 . . . . 0.0 111.094 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.443 ' HA ' HD12 ' A' ' 40' ' ' LEU . 58.2 Cg_endo -67.89 -25.92 38.48 Favored 'Trans proline' 0 C--N 1.381 2.287 0 C-N-CA 122.85 2.367 . . . . 0.0 112.744 -176.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.9 m -63.34 -46.6 85.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.677 0.791 . . . . 0.0 111.38 -175.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -61.07 -34.56 75.09 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.576 0.75 . . . . 0.0 111.511 174.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.586 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.6 mt -70.96 -42.06 70.27 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.856 0.723 . . . . 0.0 110.874 -177.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -66.68 -48.08 70.43 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.934 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.03 -27.33 65.57 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.233 0.333 . . . . 0.0 111.497 -177.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.09 -37.37 69.58 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.629 0.371 . . . . 0.0 110.441 172.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 HD22 ' A' ' 28' ' ' LEU . 1.8 mm? -73.13 -23.96 60.54 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.727 0.811 . . . . 0.0 109.501 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -74.37 -51.68 14.36 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.804 1.241 . . . . 0.0 110.3 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.13 -16.52 63.67 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.817 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 92.6 p -101.2 -7.19 23.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.303 0.641 . . . . 0.0 111.76 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 64.54 22.62 12.71 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.532 1.133 . . . . 0.0 111.583 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.76 -7.54 31.64 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.933 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.52 112.21 14.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.018 0.527 . . . . 0.0 109.718 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.576 ' O ' HG23 ' A' ' 55' ' ' VAL . 9.3 tp -59.72 -42.08 87.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.997 -175.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.8 m -64.02 -46.43 84.52 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 124.07 0.948 . . . . 0.0 111.206 -173.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -63.14 -42.98 99.58 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.767 176.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.35 -42.62 82.37 Favored 'General case' 0 C--O 1.247 0.949 0 O-C-N 123.906 0.754 . . . . 0.0 111.512 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 51' ' ' ILE . 47.0 t -60.17 -49.35 84.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.308 0.643 . . . . 0.0 109.773 175.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.4 t -62.59 -35.47 79.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.857 0.723 . . . . 0.0 112.025 -177.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.59 -27.0 55.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.565 0.746 . . . . 0.0 111.539 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.597 HD13 HD12 ' A' ' 34' ' ' ILE . 72.1 mt -86.85 -38.94 16.32 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 173.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 77.5 p . . . . . 0 N--CA 1.487 1.408 0 C-N-CA 123.292 0.637 . . . . 0.0 110.896 178.582 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.2 t70 . . . . . 0 C--O 1.247 0.925 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.439 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -76.36 -33.07 58.94 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 119.156 -0.45 . . . . 0.0 112.045 -173.446 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -59.73 -41.51 91.09 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.198 0.454 . . . . 0.0 109.91 174.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.99 -46.33 78.4 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.291 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.49 96.39 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.312 1.008 . . . . 0.0 112.345 -177.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 102' ' ' LEU . 49.0 mm -72.48 -45.27 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.443 0.697 . . . . 0.0 110.688 -176.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -28.13 65.71 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.949 0.5 . . . . 0.0 111.289 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 33.2 tp -71.01 -46.09 62.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.212 0.605 . . . . 0.0 109.39 175.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -58.38 -36.03 72.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.768 0.667 . . . . 0.0 110.813 175.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 110.115 179.114 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.482 1.175 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -57.42 -35.44 70.08 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.174 0.989 . . . . 0.0 112.718 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.635 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.9 mm? -68.83 -46.48 68.46 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -69.55 -39.01 77.7 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.292 0.995 . . . . 0.0 110.529 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.26 -53.21 58.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.304 1.042 . . . . 0.0 110.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -58.15 -47.92 81.86 Favored 'General case' 0 C--N 1.36 1.043 0 O-C-N 123.862 0.726 . . . . 0.0 110.349 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -53.02 -42.23 65.48 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.764 1.225 . . . . 0.0 111.404 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.66 -46.47 79.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.041 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.5 pt -96.02 2.33 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 113.512 0.931 . . . . 0.0 113.512 -171.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.515 HG21 HD12 ' A' ' 58' ' ' LEU . 69.1 p -110.0 -41.78 4.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.049 0.54 . . . . 0.0 109.831 169.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.61 7.18 59.2 Favored Glycine 0 C--N 1.343 0.949 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.678 -176.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.572 HD12 HD13 ' A' ' 58' ' ' LEU . 79.0 mt -95.74 110.08 23.72 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 C-N-CA 124.053 0.941 . . . . 0.0 109.306 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -77.5 -17.74 57.7 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.9 0.88 . . . . 0.0 111.107 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 3.0 m-20 -65.19 108.08 1.84 Allowed Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 124.997 1.319 . . . . 0.0 110.011 -177.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.28 -26.75 35.28 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 123.114 2.543 . . . . 0.0 112.384 -171.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.7 t -62.39 -47.83 82.43 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.025 0.53 . . . . 0.0 109.858 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -57.89 -36.15 72.01 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.07 0.856 . . . . 0.0 111.492 176.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.528 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 mt -71.22 -51.12 26.47 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 123.972 0.795 . . . . 0.0 111.216 -174.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -60.62 -42.35 96.68 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.237 0.615 . . . . 0.0 111.585 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.487 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 40.4 mt-10 -65.99 -35.59 80.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.119 0.568 . . . . 0.0 112.144 -179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -44.77 66.43 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 123.536 0.523 . . . . 0.0 110.572 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.7 mm? -61.67 -35.55 78.29 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 124.187 0.929 . . . . 0.0 110.172 176.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.487 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.7 tmmm? -68.38 -45.29 73.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.843 0.857 . . . . 0.0 110.174 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.95 -17.97 63.34 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.789 0.836 . . . . 0.0 112.018 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 77.4 p -103.72 0.76 30.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.735 0.814 . . . . 0.0 111.507 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.0 m120 65.0 14.69 9.52 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.963 1.305 . . . . 0.0 112.435 -178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.59 12.46 Favored Glycine 0 C--N 1.353 1.472 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.873 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -79.14 99.26 6.89 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 117.571 0.685 . . . . 0.0 109.521 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 55' ' ' VAL . 17.5 tt -61.05 -29.29 45.4 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.306 0.642 . . . . 0.0 112.518 -172.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 26.8 m -64.78 -47.73 77.06 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.896 0.478 . . . . 0.0 110.608 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -63.37 -35.67 81.16 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.562 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.78 89.22 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.118 0.886 . . . . 0.0 111.274 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 51' ' ' ILE . 41.1 t -59.0 -51.84 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.466 174.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.7 t -57.71 -39.66 77.75 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.949 1.405 . . . . 0.0 111.195 -175.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.72 -29.94 61.35 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.139 0.576 . . . . 0.0 111.808 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.572 HD13 HD12 ' A' ' 34' ' ' ILE . 72.5 mt -76.26 -38.08 56.73 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 123.239 0.337 . . . . 0.0 111.821 173.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.3 p . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.239 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.238 0.466 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.418 ' H ' HD13 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -70.16 -20.89 63.12 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.028 0.531 . . . . 0.0 111.579 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -54.79 42.47 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 171.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -28.93 65.46 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.407 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.415 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . . . -69.15 -50.9 43.6 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.453 0.701 . . . . 0.0 111.381 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.18 -41.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.422 0.689 . . . . 0.0 109.943 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.14 74.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.269 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.6 tp -68.54 -41.01 80.47 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.482 0.713 . . . . 0.0 111.542 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -65.56 -41.44 92.95 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.975 0.51 . . . . 0.0 111.367 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 mm? . . . . . 0 CA--C 1.546 0.812 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.898 178.877 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.6 ptt? . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.594 HD23 ' H ' ' A' ' 24' ' ' LEU . 1.8 pt? -63.91 -36.13 82.93 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.633 1.173 . . . . 0.0 111.923 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.8 mm? -63.85 -45.66 88.53 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.246 0.618 . . . . 0.0 110.247 176.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -74.12 -37.23 64.15 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.064 0.853 . . . . 0.0 110.983 -172.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -59.98 -52.48 65.2 Favored 'General case' 0 C--N 1.356 0.852 0 O-C-N 124.008 0.817 . . . . 0.0 109.743 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 44' ' ' LEU . 13.2 tp -62.0 -45.22 94.58 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.338 1.024 . . . . 0.0 110.954 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -58.3 -39.31 78.99 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.994 0.918 . . . . 0.0 111.583 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.78 -50.78 61.57 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.596 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.0 pt -81.61 -19.77 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.531 HG21 HD12 ' A' ' 58' ' ' LEU . 80.6 p -99.35 -42.77 6.84 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.026 0.53 . . . . 0.0 110.556 178.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.12 -0.05 57.28 Favored Glycine 0 N--CA 1.469 0.849 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.329 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.713 HD12 HD13 ' A' ' 58' ' ' LEU . 95.4 mt -80.42 111.5 17.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.852 0.861 . . . . 0.0 109.524 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -75.04 -34.77 61.9 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.783 0.833 . . . . 0.0 110.527 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -56.51 106.65 0.71 Allowed Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 124.457 1.103 . . . . 0.0 111.241 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.543 ' HA ' HD12 ' A' ' 40' ' ' LEU . 59.8 Cg_endo -68.45 -21.16 40.9 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 122.897 2.398 . . . . 0.0 112.103 -175.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -66.69 -44.64 81.21 Favored 'General case' 0 C--N 1.349 0.579 0 C-N-CA 123.541 0.736 . . . . 0.0 110.862 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.448 ' HB3' HG21 ' A' ' 34' ' ' ILE . 2.0 t80 -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.285 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 37' ' ' PRO . 47.4 mt -72.21 -42.82 65.32 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.649 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -60.36 -43.13 96.83 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.273 0.629 . . . . 0.0 110.908 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.551 ' HA ' ' HE3' ' A' ' 45' ' ' LYS . 44.3 mt-10 -63.09 -39.03 93.51 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.623 0.769 . . . . 0.0 111.471 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.42 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -65.79 -46.72 77.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.319 0.648 . . . . 0.0 111.506 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.558 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -66.82 -30.49 70.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.038 0.935 . . . . 0.0 110.753 -179.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -75.1 -40.68 59.79 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.112 0.965 . . . . 0.0 110.108 179.018 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.57 -35.16 80.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.633 0.773 . . . . 0.0 110.365 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 m -91.12 -3.53 57.01 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.473 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 62.59 20.91 12.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.232 1.413 . . . . 0.0 112.607 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 120.93 -5.25 11.36 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 119.426 -0.652 . . . . 0.0 113.483 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -87.17 115.51 24.61 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.443 0.621 . . . . 0.0 111.012 -178.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.0 tp -66.0 -32.28 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 123.916 0.886 . . . . 0.0 111.733 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -66.44 -47.44 73.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.088 0.955 . . . . 0.0 111.786 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -69.13 -38.24 78.75 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 176.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.98 67.63 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 123.794 0.683 . . . . 0.0 111.893 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.53 -39.93 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.86 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -61.97 -31.3 71.63 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.174 0.59 . . . . 0.0 111.854 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.9 mt -83.17 -36.3 24.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.994 0.918 . . . . 0.0 111.518 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 HD12 ' A' ' 34' ' ' ILE . 53.2 mt -73.15 -29.15 62.67 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 177.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.2 p . . . . . 0 N--CA 1.471 0.624 0 C-N-CA 122.766 0.427 . . . . 0.0 110.063 173.853 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.37 77.5 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.349 0.522 . . . . 0.0 110.65 176.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -61.74 -50.37 72.67 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.797 0.686 . . . . 0.0 109.98 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.19 -31.81 70.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.6 1.187 . . . . 0.0 111.651 -176.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -72.02 -46.57 56.61 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.599 0.76 . . . . 0.0 111.161 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.9 mm -67.66 -39.3 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.419 0.687 . . . . 0.0 109.596 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.39 97.03 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.09 0.956 . . . . 0.0 111.43 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.37 -40.64 85.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 0.0 109.239 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 t -65.55 -41.29 93.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.297 0.639 . . . . 0.0 111.419 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 39.8 tp . . . . . 0 N--CA 1.472 0.638 0 C-N-CA 123.256 0.622 . . . . 0.0 110.181 -177.292 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.541 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -62.08 -38.25 88.14 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.541 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.5 mm? -65.58 -46.15 80.54 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 176.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -64.45 -50.14 68.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.944 -174.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.28 71.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 112.047 -177.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.562 HD11 HD12 ' A' ' 58' ' ' LEU . 2.3 tm? -68.34 -38.07 81.15 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.2 -177.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -65.54 -35.65 81.48 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.178 0.591 . . . . 0.0 110.941 172.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.64 -39.12 92.86 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.58 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.2 pt -96.41 -13.97 7.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.7 p -102.43 -51.83 3.25 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.05 0.841 . . . . 0.0 110.89 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.75 7.22 42.31 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.378 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.657 HD12 HD13 ' A' ' 58' ' ' LEU . 60.6 mt -86.81 123.32 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.03 0.532 . . . . 0.0 110.891 -175.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -88.66 -11.63 44.74 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.98 0.912 . . . . 0.0 111.932 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.52 111.74 10.57 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-O 118.653 -0.689 . . . . 0.0 109.702 175.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.88 -36.92 81.31 Favored 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.014 2.476 . . . . 0.0 112.256 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.473 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 55.6 m -62.69 -48.9 77.3 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.577 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -52.76 -40.67 63.36 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.232 1.013 . . . . 0.0 112.127 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 28' ' ' LEU . 27.6 mt -66.26 -47.87 72.32 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 124.2 0.938 . . . . 0.0 109.788 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -61.19 -42.09 97.96 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.218 175.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 38' ' ' SER . 14.1 mm-40 -69.85 -32.98 71.66 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.356 1.063 . . . . 0.0 110.669 -174.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.87 -46.86 70.52 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 123.975 0.797 . . . . 0.0 110.672 175.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.431 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.6 mm? -64.31 -34.81 78.99 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.878 0.871 . . . . 0.0 109.939 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 4.1 tmmm? -69.98 -42.21 73.42 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.224 1.01 . . . . 0.0 110.244 178.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.63 -22.19 60.07 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.825 0.85 . . . . 0.0 111.358 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -104.38 5.2 34.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.287 0.635 . . . . 0.0 111.642 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 66.31 17.57 10.73 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.228 1.011 . . . . 0.0 111.529 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.49 -3.36 24.9 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.72 178.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -82.59 111.54 18.67 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.555 0.742 . . . . 0.0 110.087 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.446 HG13 HD23 ' A' ' 28' ' ' LEU . 20.6 tt -74.33 -24.6 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 122.742 0.417 . . . . 0.0 111.915 -174.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.7 m -71.66 -44.81 63.63 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.587 0.755 . . . . 0.0 110.535 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -71.45 -34.66 70.44 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.119 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -51.72 68.34 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.646 0.778 . . . . 0.0 112.242 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.43 -39.28 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 122.581 0.352 . . . . 0.0 110.741 175.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.2 t -59.82 -31.38 69.68 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.012 0.525 . . . . 0.0 111.719 178.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 88.0 mt -78.92 -41.33 29.76 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.207 0.603 . . . . 0.0 111.552 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.657 HD13 HD12 ' A' ' 34' ' ' ILE . 74.1 mt -76.22 -21.06 56.86 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.478 0.945 0 C-N-CA 122.879 0.472 . . . . 0.0 111.741 176.075 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -26.35 67.74 Favored 'General case' 0 C--N 1.349 0.565 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.225 -178.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -63.49 -55.53 23.3 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.43 -38.51 80.86 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.359 0.664 . . . . 0.0 111.751 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.82 -54.44 38.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.492 0.717 . . . . 0.0 111.807 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.16 -44.68 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.824 0.85 . . . . 0.0 110.583 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.25 -49.53 75.34 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.716 0.806 . . . . 0.0 111.497 -176.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.82 -39.65 83.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.927 0.891 . . . . 0.0 110.228 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -68.07 -44.95 75.17 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.736 0.415 . . . . 0.0 111.148 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt . . . . . 0 N--CA 1.475 0.82 0 C-N-CA 123.049 0.54 . . . . 0.0 111.568 179.757 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 111.421 0.156 . . . . 0.0 111.421 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.495 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.1 pt? -64.78 -35.14 80.13 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.83 0.852 . . . . 0.0 111.623 177.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.09 -53.24 58.17 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 71.3 m-20 -64.67 -45.54 86.28 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.941 -173.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -61.4 -55.46 31.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.147 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.581 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.9 tp -59.76 -47.15 86.81 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 123.472 0.482 . . . . 0.0 110.45 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -53.37 -40.23 64.81 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.694 1.198 . . . . 0.0 111.857 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.76 -46.64 62.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.047 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 pt -89.9 -0.67 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.525 HG21 HD12 ' A' ' 58' ' ' LEU . 74.2 p -108.31 -46.98 3.61 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.682 0.793 . . . . 0.0 109.574 170.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.43 -8.28 40.67 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.467 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 75.0 mt -80.47 117.23 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.115 0.966 . . . . 0.0 110.486 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -83.48 -17.03 43.37 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.224 0.953 . . . . 0.0 111.22 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.72 108.8 2.41 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.116 0.966 . . . . 0.0 109.776 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.74 -30.31 59.35 Favored 'Trans proline' 0 C--N 1.379 2.136 0 C-N-CA 122.725 2.284 . . . . 0.0 112.517 -173.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.508 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 57.3 m -58.48 -52.59 64.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.018 0.527 . . . . 0.0 110.433 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -51.68 -35.08 41.2 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.303 1.041 . . . . 0.0 112.046 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.581 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.5 mt -70.96 -45.98 63.18 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 123.802 0.689 . . . . 0.0 110.643 -177.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -66.48 -37.02 84.18 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.712 0.405 . . . . 0.0 111.379 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 38' ' ' SER . 18.5 mm-40 -64.22 -46.21 84.86 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.226 1.01 . . . . 0.0 110.765 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -41.1 96.69 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.63 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.495 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.3 mm? -69.74 -37.49 76.48 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.387 0.675 . . . . 0.0 111.524 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -74.26 -36.57 63.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.433 0.293 . . . . 0.0 110.521 -176.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -77.64 -22.02 51.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.242 0.617 . . . . 0.0 111.804 -177.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.6 p -94.96 3.13 55.3 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.234 0.614 . . . . 0.0 111.795 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 75.92 -18.7 0.45 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 125.084 1.354 . . . . 0.0 112.004 -175.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 140.05 -7.16 2.91 Favored Glycine 0 C--N 1.343 0.929 0 N-CA-C 111.971 -0.452 . . . . 0.0 111.971 -172.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -78.23 107.27 10.72 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.038 0.535 . . . . 0.0 110.558 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.463 ' O ' HG23 ' A' ' 55' ' ' VAL . 13.3 tt -66.98 -26.63 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.5 m -67.03 -50.22 62.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.397 0.618 . . . . 0.0 110.207 177.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 16.5 mm100 -61.99 -36.06 80.36 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.612 176.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.75 90.94 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 123.758 0.823 . . . . 0.0 111.7 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -59.97 -45.48 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 173.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -58.71 -35.59 72.9 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.724 0.809 . . . . 0.0 111.756 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.3 mt -71.63 -40.03 70.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.31 0.644 . . . . 0.0 111.034 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.525 HD12 HG21 ' A' ' 32' ' ' THR . 51.9 mt -75.61 -25.15 56.71 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p . . . . . 0 CA--C 1.548 0.881 0 C-N-CA 122.463 0.305 . . . . 0.0 110.441 174.678 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.3 t70 . . . . . 0 CA--C 1.549 0.928 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -29.35 70.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.979 0.512 . . . . 0.0 111.646 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -64.31 -52.71 57.18 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.091 0.556 . . . . 0.0 110.944 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.64 -30.23 68.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.323 0.649 . . . . 0.0 111.498 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.88 -54.69 30.83 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.714 0.806 . . . . 0.0 110.941 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -70.76 -36.78 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.471 0.708 . . . . 0.0 110.773 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.35 -38.91 92.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.828 0.851 . . . . 0.0 111.123 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 52.3 tp -70.94 -41.19 71.48 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.7 m -63.58 -29.58 70.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.851 0.46 . . . . 0.0 111.259 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 56.5 tp . . . . . 0 N--CA 1.472 0.627 0 C-N-CA 124.171 0.989 . . . . 0.0 109.874 179.177 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.521 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.4 pt? -66.26 -39.43 89.46 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.589 0.756 . . . . 0.0 111.12 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.521 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -66.98 -46.94 73.07 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.12 0.568 . . . . 0.0 110.188 177.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -62.16 -52.05 65.4 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.64 1.213 . . . . 0.0 110.968 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -58.42 -53.7 55.4 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.204 0.94 . . . . 0.0 111.043 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.442 HD12 HD22 ' A' ' 40' ' ' LEU . 2.1 tm? -56.24 -50.75 70.41 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.259 0.974 . . . . 0.0 110.027 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.436 ' HB2' HD13 ' A' ' 40' ' ' LEU . 72.4 ttt180 -61.14 -33.73 73.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.117 0.967 . . . . 0.0 111.952 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -74.12 -40.41 62.69 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.568 0.747 . . . . 0.0 110.723 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 pt -95.18 -15.5 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.589 -169.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.402 HG22 HG13 ' A' ' 55' ' ' VAL . 72.9 p -96.36 -43.13 7.8 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.95 -4.69 61.18 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.868 -177.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.495 HD12 HD13 ' A' ' 58' ' ' LEU . 62.5 mt -75.3 120.36 24.81 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 123.756 0.822 . . . . 0.0 109.443 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -86.43 -17.55 34.01 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.57 0.748 . . . . 0.0 111.353 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -70.16 109.48 4.93 Favored Pre-proline 0 N--CA 1.483 1.18 0 C-N-CA 123.544 0.738 . . . . 0.0 110.205 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.6 -25.46 79.3 Favored 'Trans proline' 0 C--N 1.388 2.637 0 C-N-CA 123.217 2.611 . . . . 0.0 113.255 -175.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m -58.36 -51.74 68.54 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.662 0.601 . . . . 0.0 110.555 177.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.15 -36.46 79.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.733 0.813 . . . . 0.0 111.423 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.442 HD22 HD12 ' A' ' 28' ' ' LEU . 13.9 mt -68.2 -56.67 7.88 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 124.386 1.054 . . . . 0.0 109.521 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -59.86 -50.19 74.75 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.117 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -56.68 -40.21 75.15 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.568 0.747 . . . . 0.0 111.903 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.8 87.3 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.739 0.65 . . . . 0.0 110.873 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.428 HD23 ' O ' ' A' ' 40' ' ' LEU . 4.3 mm? -69.35 -23.53 63.78 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.825 0.85 . . . . 0.0 111.888 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -47.94 17.87 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.31 86.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 124.228 0.955 . . . . 0.0 110.943 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.9 m -89.58 -3.29 58.37 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.778 0.831 . . . . 0.0 111.908 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.453 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER 64.2 21.94 12.7 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.69 1.196 . . . . 0.0 112.47 176.256 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.26 -8.56 24.79 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-O 119.675 -0.514 . . . . 0.0 113.218 178.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.06 111.86 13.09 Favored 'General case' 0 C--O 1.246 0.918 0 CA-C-N 117.329 0.564 . . . . 0.0 110.519 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 55' ' ' VAL . 5.7 tp -65.98 -34.46 70.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 C-N-CA 123.268 0.627 . . . . 0.0 111.351 -173.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 35.7 m -66.65 -49.97 64.47 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.823 0.849 . . . . 0.0 110.866 -173.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -64.28 -39.94 94.96 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.259 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.88 -52.89 59.05 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.071 0.857 . . . . 0.0 112.317 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.9 t -63.73 -44.0 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 122.973 0.509 . . . . 0.0 110.433 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 t -58.5 -43.67 89.15 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 124.261 0.976 . . . . 0.0 111.187 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.16 -30.23 62.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.957 -176.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.495 HD13 HD12 ' A' ' 34' ' ' ILE . 72.8 mt -72.33 -40.71 67.21 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.481 1.088 0 C-N-CA 122.868 0.467 . . . . 0.0 111.62 -178.166 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 . . . . . 0 N--CA 1.467 0.391 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -32.1 73.42 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.225 0.61 . . . . 0.0 110.365 175.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -62.82 -56.92 13.15 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.794 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.75 -33.31 75.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 124.095 0.872 . . . . 0.0 111.421 -176.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.05 -59.62 4.24 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.427 0.691 . . . . 0.0 111.517 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.46 -41.19 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.468 0.707 . . . . 0.0 110.776 -176.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.82 -42.55 90.47 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.258 0.623 . . . . 0.0 111.799 -178.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.34 -40.91 77.27 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.6 t -62.55 -43.89 97.69 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.502 0.721 . . . . 0.0 111.332 179.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tt . . . . . 0 N--CA 1.481 1.092 0 C-N-CA 123.788 0.835 . . . . 0.0 109.786 -176.638 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -61.08 -46.44 90.62 Favored 'General case' 0 C--O 1.253 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 111.072 -178.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.522 HD22 ' HB2' ' A' ' 40' ' ' LEU . 44.3 mt -74.32 -42.58 59.23 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.817 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -62.92 -42.48 99.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.056 0.847 . . . . 0.0 111.247 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.47 ' O ' HG12 ' A' ' 31' ' ' ILE . 13.5 mm100 -63.26 -57.99 8.63 Favored 'General case' 0 C--N 1.356 0.851 0 CA-C-O 118.681 -0.676 . . . . 0.0 110.188 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' A' ' 40' ' ' LEU . 16.8 mt -51.49 -53.23 39.53 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 123.979 0.799 . . . . 0.0 111.387 176.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -53.14 -38.66 62.9 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.567 1.147 . . . . 0.0 112.162 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.49 -51.66 33.8 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.287 0.635 . . . . 0.0 110.846 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 27' ' ' GLN . 4.6 pt -91.28 4.03 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -172.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.464 HG21 HD12 ' A' ' 58' ' ' LEU . 45.3 p -122.1 -38.62 2.68 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.432 0.693 . . . . 0.0 110.344 175.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.94 -1.68 63.42 Favored Glycine 0 N--CA 1.475 1.287 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.488 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.44 ' HB ' HD21 ' A' ' 40' ' ' LEU . 86.0 mt -79.73 117.31 25.26 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 123.77 0.828 . . . . 0.0 109.922 -178.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -81.97 -18.6 42.9 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.739 0.649 . . . . 0.0 110.694 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 5.5 m-20 -68.77 104.88 0.81 Allowed Pre-proline 0 N--CA 1.481 1.076 0 C-N-CA 123.991 0.916 . . . . 0.0 109.747 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.71 -25.31 34.0 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.648 2.232 . . . . 0.0 111.799 -174.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.422 ' O ' ' HG3' ' A' ' 42' ' ' GLU . 42.8 m -66.61 -42.58 86.61 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.909 0.884 . . . . 0.0 110.806 177.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -66.08 -38.67 88.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.874 0.87 . . . . 0.0 109.821 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.522 ' HB2' HD22 ' A' ' 25' ' ' LEU . 56.5 mt -64.58 -41.42 96.27 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.604 175.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -62.5 -44.67 95.82 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 38' ' ' SER . 52.4 mt-10 -61.16 -37.87 84.44 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.587 0.555 . . . . 0.0 111.339 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.39 -48.15 62.04 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.786 0.679 . . . . 0.0 110.994 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.38 -40.62 78.55 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.397 1.079 . . . . 0.0 110.35 179.284 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.66 -37.04 59.93 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.295 1.038 . . . . 0.0 111.722 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -15.75 62.88 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.686 0.394 . . . . 0.0 111.547 178.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -106.94 11.27 30.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.853 0.861 . . . . 0.0 110.982 177.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 65.82 15.79 10.2 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.489 1.116 . . . . 0.0 112.827 175.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.15 -0.34 28.31 Favored Glycine 0 C--N 1.341 0.83 0 C-N-CA 123.36 0.505 . . . . 0.0 112.343 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -83.55 110.4 18.19 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 123.182 0.593 . . . . 0.0 111.078 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.58 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.1 tp -56.34 -38.71 56.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.707 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -58.43 -60.02 4.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.75 1.22 . . . . 0.0 112.279 -173.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.435 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 mm100 -66.93 -28.57 68.4 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.286 178.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.42 93.05 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.34 0.4 . . . . 0.0 111.019 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 51' ' ' ILE . 20.5 t -60.09 -46.99 93.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.131 0 O-C-N 123.762 0.664 . . . . 0.0 109.306 175.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.3 t -53.65 -50.41 65.82 Favored 'General case' 0 C--N 1.354 0.8 0 O-C-N 124.609 1.193 . . . . 0.0 111.683 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 89.3 mt -60.47 -44.13 96.22 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.689 0.618 . . . . 0.0 111.336 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.464 HD12 HG21 ' A' ' 32' ' ' THR . 71.6 mt -73.26 -30.88 63.74 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 42.9 p . . . . . 0 N--CA 1.473 0.688 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 176.452 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 . . . . . 0 N--CA 1.483 1.2 0 CA-C-O 120.738 0.304 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -23.23 41.01 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.693 -177.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -59.64 -55.83 29.45 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.64 -31.44 68.37 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.337 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.09 -56.53 21.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.861 0.464 . . . . 0.0 111.134 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.47 -43.35 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.011 0.524 . . . . 0.0 110.776 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.67 68.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.916 0.887 . . . . 0.0 111.639 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.88 -41.19 75.12 Favored 'General case' 0 C--N 1.351 0.646 0 O-C-N 123.758 0.661 . . . . 0.0 111.331 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.8 m -64.61 -31.02 72.05 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 123.369 0.418 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.551 0.981 0 C-N-CA 123.821 0.848 . . . . 0.0 109.672 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 . . . . . 0 N--CA 1.486 1.33 0 N-CA-C 110.269 -0.271 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 54.7 ttm -54.32 -46.14 72.77 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.344 1.058 . . . . 0.0 113.292 -167.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.541 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.6 pt? -63.42 -37.26 86.59 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -177.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.482 HD12 ' HB2' ' A' ' 40' ' ' LEU . 3.0 mm? -68.17 -44.48 75.83 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 176.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -65.84 -46.87 76.93 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 124.244 0.965 . . . . 0.0 111.044 -176.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.411 ' O ' HG12 ' A' ' 31' ' ' ILE . 4.6 mm100 -59.63 -56.42 22.12 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 124.699 1.249 . . . . 0.0 110.858 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 40' ' ' LEU . 18.7 tp -56.98 -48.26 78.83 Favored 'General case' 0 C--N 1.36 1.031 0 O-C-N 124.095 0.872 . . . . 0.0 110.868 -179.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.4 ttt180 -55.1 -41.93 72.25 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.751 0.82 . . . . 0.0 111.434 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.55 -44.05 83.42 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 124.234 1.014 . . . . 0.0 109.948 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.7 pt -97.66 2.26 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 -171.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.536 HG21 HD12 ' A' ' 58' ' ' LEU . 68.0 p -114.11 -49.6 2.85 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 121.242 0.544 . . . . 0.0 110.1 170.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 111.69 -10.59 27.87 Favored Glycine 0 C--N 1.338 0.68 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.784 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.717 HD12 HD13 ' A' ' 58' ' ' LEU . 90.5 mt -71.32 119.86 18.41 Favored 'Isoleucine or valine' 0 C--N 1.35 0.616 0 C-N-CA 123.399 0.68 . . . . 0.0 110.652 -178.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -86.37 -20.63 27.99 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.139 0.976 . . . . 0.0 111.685 -175.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 25.8 t70 -70.81 114.46 26.98 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.194 0.598 . . . . 0.0 110.405 -178.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.08 -30.52 65.83 Favored 'Trans proline' 0 C--N 1.382 2.299 0 C-N-CA 122.735 2.29 . . . . 0.0 113.24 -174.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.5 t -68.66 -43.13 76.87 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.746 0.419 . . . . 0.0 110.114 -178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.34 -32.09 70.92 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.524 1.129 . . . . 0.0 110.662 -179.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.5 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.8 mt -70.42 -48.72 54.75 Favored 'General case' 0 C--O 1.244 0.813 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.587 178.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -55.43 -47.01 76.63 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.838 173.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -68.33 -28.48 67.19 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.553 0.741 . . . . 0.0 111.932 -173.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -68.98 -46.68 67.46 Favored 'General case' 0 CA--C 1.538 0.483 0 O-C-N 123.541 0.526 . . . . 0.0 110.831 172.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.541 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.0 mm? -61.68 -31.54 71.68 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.717 0.807 . . . . 0.0 110.632 175.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -74.52 -38.36 62.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.8 0.84 . . . . 0.0 110.758 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.15 -33.11 69.74 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.62 0.768 . . . . 0.0 111.036 -178.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.1 p -91.03 2.2 56.5 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 123.936 0.894 . . . . 0.0 111.474 -178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 66.8 t30 63.21 16.79 9.69 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.657 1.183 . . . . 0.0 111.946 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 125.92 -25.45 5.54 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.395 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -74.86 106.86 6.59 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 117.306 0.553 . . . . 0.0 110.536 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.457 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.8 tt -68.89 -27.9 37.55 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.055 0.542 . . . . 0.0 112.079 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -66.66 -46.33 76.05 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.469 0.707 . . . . 0.0 110.637 176.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.429 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.5 mm-40 -62.52 -37.28 85.44 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.612 173.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.93 -41.66 87.87 Favored 'General case' 0 C--O 1.244 0.763 0 C-N-CA 123.523 0.729 . . . . 0.0 111.001 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.1 t -60.8 -51.24 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 O-C-N 123.709 0.631 . . . . 0.0 110.165 174.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -55.04 -39.32 69.02 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 124.386 1.054 . . . . 0.0 111.538 -177.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 91.8 mt -73.4 -37.07 66.07 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.205 -0.907 . . . . 0.0 111.399 -178.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.717 HD13 HD12 ' A' ' 34' ' ' ILE . 50.0 mt -74.11 -33.36 63.56 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-O 120.55 0.214 . . . . 0.0 111.484 177.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.4 p -83.77 8.12 15.68 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 123.096 0.558 . . . . 0.0 111.175 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.521 ' HA ' ' HB ' ' A' ' 63' ' ' VAL . 33.8 t70 -58.36 -23.53 57.16 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.399 0.68 . . . . 0.0 111.174 172.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -55.78 -21.69 20.47 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 123.865 0.866 . . . . 0.0 112.699 172.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.25 2.38 5.76 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.128 0.971 . . . . 0.0 111.757 177.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.521 ' HB ' ' HA ' ' A' ' 60' ' ' ASP . 73.9 t -105.87 -15.39 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 123.742 0.817 . . . . 0.0 110.416 177.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.53 -28.91 65.91 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 124.423 1.089 . . . . 0.0 112.917 -176.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -59.17 132.18 87.49 Favored Pre-proline 0 CA--C 1.558 1.258 0 C-N-CA 124.625 1.17 . . . . 0.0 111.855 -174.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -70.38 131.56 20.38 Favored 'Cis proline' 0 C--N 1.388 2.657 0 CA-C-N 120.24 1.122 . . . . 0.0 112.986 3.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.2 p -73.11 -172.74 1.13 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 111.708 -174.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -73.17 -175.44 1.85 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.415 0.686 . . . . 0.0 110.799 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -62.7 92.79 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.279 0.632 . . . . 0.0 111.696 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 44.4 p -102.23 82.72 2.23 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 168.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.24 111.84 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.068 -170.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -75.62 71.7 2.54 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.945 0.898 . . . . 0.0 110.53 -178.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 91.5 m -144.85 115.32 7.63 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.088 -175.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -82.52 124.39 77.81 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 124.193 0.997 . . . . 0.0 108.927 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.86 124.69 12.94 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.464 2.776 . . . . 0.0 113.447 175.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 24.6 m -63.02 117.84 7.01 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.69 0.796 . . . . 0.0 110.64 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -29.04 66.88 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.656 0.783 . . . . 0.0 111.36 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 46.3 t -98.32 108.42 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -112.95 97.65 6.67 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.595 0.758 . . . . 0.0 109.187 178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -71.17 -26.57 73.42 Favored Glycine 0 C--N 1.347 1.179 0 CA-C-N 115.911 -0.586 . . . . 0.0 112.46 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 12.8 p -74.04 82.68 1.75 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 124.187 0.995 . . . . 0.0 110.308 176.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -82.85 -34.07 26.92 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.362 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -73.66 97.27 2.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.506 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -63.45 -27.99 69.67 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.777 0.831 . . . . 0.0 110.744 175.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -71.07 113.24 7.91 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.983 172.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -105.02 104.77 14.56 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.57 0.748 . . . . 0.0 109.202 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.55 92.48 3.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.702 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.9 tp -87.54 92.88 9.25 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -121.64 100.74 7.18 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.418 ' N ' ' HE2' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -64.65 160.24 20.24 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.08 0.552 . . . . 0.0 111.974 -177.805 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 30.8 m -120.2 34.65 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-O 121.584 0.706 . . . . 0.0 109.887 176.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 16.8 mt -90.79 28.52 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.728 0 C-N-CA 124.18 0.992 . . . . 0.0 110.248 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -77.44 83.89 3.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.896 0.855 . . . . 0.0 109.969 176.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.439 HD23 ' H ' ' A' ' 94' ' ' LEU . 1.8 pt? -84.23 57.28 4.15 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-O 122.588 1.185 . . . . 0.0 110.227 176.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.0 t -76.16 76.61 2.99 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.336 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -80.0 -34.56 38.41 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 114.286 -1.325 . . . . 0.0 109.274 -177.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.3 p30 42.77 29.09 0.15 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 126.591 1.956 . . . . 0.0 114.649 172.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -65.24 114.45 4.72 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.957 0.503 . . . . 0.0 110.555 -175.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -69.51 155.52 40.34 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 124.184 0.928 . . . . 0.0 110.587 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -73.27 -15.83 61.4 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.261 0.624 . . . . 0.0 111.54 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -62.86 -62.02 2.01 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 123.665 0.786 . . . . 0.0 111.457 -176.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -29.04 64.94 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.07 0.395 . . . . 0.0 111.0 -177.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -64.19 -52.68 57.73 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.025 0.53 . . . . 0.0 110.468 178.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.01 -23.22 61.36 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 124.156 0.91 . . . . 0.0 111.4 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.38 -52.98 21.88 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.939 0.496 . . . . 0.0 111.025 175.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.8 mm -64.01 -43.23 97.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.718 0.807 . . . . 0.0 109.611 177.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.74 -41.71 95.91 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.03 0.932 . . . . 0.0 110.911 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 10.1 tt -66.16 -44.82 82.99 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.861 0.865 . . . . 0.0 110.213 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -64.39 -34.4 78.08 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.489 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -80.36 -28.0 38.11 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.203 0.601 . . . . 0.0 110.869 178.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.76 -34.43 69.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 122.976 0.51 . . . . 0.0 111.364 177.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -84.69 12.34 7.37 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.4 t -52.96 119.22 15.7 Favored Pre-proline 0 CA--C 1.554 1.104 0 C-N-CA 123.647 0.779 . . . . 0.0 110.335 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.17 158.34 15.15 Favored 'Trans proline' 0 C--N 1.382 2.304 0 C-N-CA 123.132 2.555 . . . . 0.0 114.573 -174.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.69 -4.77 39.33 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.168 175.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.478 HG23 ' H ' ' A' ' 121' ' ' ARG . 45.9 mm -64.57 109.44 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 168.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -100.14 9.41 42.84 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.161 0.585 . . . . 0.0 111.713 -177.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -157.6 81.99 0.89 Allowed 'General case' 0 C--N 1.351 0.633 0 C-N-CA 122.192 0.197 . . . . 0.0 110.995 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 38.6 t70 65.17 -71.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 125.336 1.454 . . . . 0.0 113.204 169.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -163.64 75.32 0.17 Allowed Glycine 0 C--N 1.347 1.158 0 N-CA-C 112.243 -0.343 . . . . 0.0 112.243 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.478 ' H ' HG23 ' A' ' 116' ' ' ILE . 28.5 mmm180 -94.29 23.35 5.19 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.866 0.866 . . . . 0.0 111.921 179.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.435 ' HB3' HD22 ' A' ' 123' ' ' LEU . 19.2 t70 -60.19 -40.47 90.18 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.63 0.772 . . . . 0.0 110.027 173.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.435 HD22 ' HB3' ' A' ' 122' ' ' ASP . 2.7 mm? -86.24 37.13 0.71 Allowed 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.011 -177.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -64.25 128.64 36.69 Favored 'General case' 0 C--N 1.351 0.647 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 168.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.2 tpm_? 64.51 38.6 7.32 Favored 'General case' 0 CA--C 1.559 1.301 0 O-C-N 124.43 1.081 . . . . 0.0 111.032 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.54 164.06 27.04 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.13 173.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -121.59 102.98 8.58 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 173.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -64.87 -28.12 69.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.413 0.685 . . . . 0.0 112.525 -175.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 67.55 29.98 6.91 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.801 1.241 . . . . 0.0 112.314 175.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.4 m -75.61 91.53 2.86 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 174.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.5 p -77.72 91.07 4.03 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.927 -178.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.966 0 C-N-CA 124.379 1.072 . . . . 0.0 109.239 -179.264 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 13.4 mm100 . . . . . 0 N--CA 1.477 0.901 0 CA-C-O 119.328 -0.368 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 14.1 tpt -50.02 -43.81 50.94 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.668 0.787 . . . . 0.0 111.661 -177.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.59 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.5 pt? -70.48 -38.16 74.35 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.659 0.784 . . . . 0.0 111.926 -178.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.59 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.0 mm? -65.67 -53.19 44.54 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.824 0.449 . . . . 0.0 110.072 178.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -65.05 -41.41 95.19 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.968 1.418 . . . . 0.0 111.66 -176.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 -57.83 -51.49 69.38 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.802 0.441 . . . . 0.0 110.125 173.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.455 HD22 ' CD2' ' A' ' 44' ' ' LEU . 14.4 tp -63.08 -37.32 86.72 Favored 'General case' 0 C--N 1.362 1.119 0 O-C-N 123.697 0.623 . . . . 0.0 110.821 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 20.2 ttp180 -63.02 -39.34 94.46 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.147 0.979 . . . . 0.0 110.62 -176.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.56 -20.18 34.27 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.564 -1.198 . . . . 0.0 112.422 -177.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.454 HG12 ' HA ' ' A' ' 28' ' ' LEU . 17.1 pt -99.4 -8.32 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 176.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.476 HG21 HD12 ' A' ' 58' ' ' LEU . 69.2 p -108.54 -48.12 3.38 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.06 0.544 . . . . 0.0 110.675 174.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 110.84 -16.44 28.24 Favored Glycine 0 N--CA 1.467 0.74 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.81 -175.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.678 HD12 HD13 ' A' ' 58' ' ' LEU . 57.0 mt -72.68 107.23 3.26 Favored 'Isoleucine or valine' 0 C--N 1.357 0.91 0 C-N-CA 124.039 0.935 . . . . 0.0 110.238 -174.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 35.4 mm-40 -78.77 -1.69 35.95 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.025 0.93 . . . . 0.0 111.793 -178.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -88.21 104.49 7.09 Favored Pre-proline 0 N--CA 1.474 0.751 0 C-N-CA 123.955 0.902 . . . . 0.0 109.656 176.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.509 ' HA ' HD12 ' A' ' 40' ' ' LEU . 37.3 Cg_endo -63.16 -25.42 72.72 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.069 2.513 . . . . 0.0 113.027 -176.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.8 m -60.44 -43.7 96.55 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.591 0.757 . . . . 0.0 111.631 178.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.418 ' CD2' HD13 ' A' ' 34' ' ' ILE . 0.7 OUTLIER -70.87 -29.47 65.58 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 123.307 0.643 . . . . 0.0 110.432 -178.384 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 37' ' ' PRO . 32.9 mt -72.58 -37.02 68.28 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.437 177.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -62.3 -44.3 96.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.202 0.601 . . . . 0.0 110.764 172.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.513 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.0 mt-10 -60.88 -39.79 90.55 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.564 0.746 . . . . 0.0 111.657 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.63 -44.51 77.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 123.648 0.592 . . . . 0.0 111.245 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.503 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -69.14 -26.01 64.66 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 124.139 0.976 . . . . 0.0 111.162 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 1.9 tmmm? -77.13 -42.71 36.81 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.791 0.837 . . . . 0.0 109.677 177.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.27 -36.36 77.03 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.573 0.749 . . . . 0.0 110.406 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 97.7 p -87.79 -5.25 58.72 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.531 0.732 . . . . 0.0 111.323 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.9 m120 64.68 24.02 12.87 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.545 1.138 . . . . 0.0 112.106 176.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.49 -2.88 30.87 Favored Glycine 0 C--N 1.347 1.143 0 CA-C-N 115.959 -0.564 . . . . 0.0 113.203 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -86.15 100.25 12.08 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.2 tt -66.62 -24.82 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.093 0 C-N-CA 123.141 0.576 . . . . 0.0 112.146 -172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 24.8 m -67.93 -45.76 73.4 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.507 0.723 . . . . 0.0 110.191 176.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -70.22 -29.97 66.93 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.875 176.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -64.9 -51.48 61.72 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 123.442 0.697 . . . . 0.0 111.375 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.1 p -65.25 -38.96 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.022 177.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -54.29 -47.54 72.26 Favored 'General case' 0 C--N 1.359 1.021 0 O-C-N 124.355 1.035 . . . . 0.0 110.297 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 92.0 mt -63.21 -45.28 92.38 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 123.759 0.662 . . . . 0.0 111.311 179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.678 HD13 HD12 ' A' ' 34' ' ' ILE . 84.6 mt -71.06 -15.48 62.54 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.583 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 68.0 p -116.64 1.16 12.81 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 122.986 0.514 . . . . 0.0 112.216 176.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.06 -32.68 39.37 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.033 0.444 . . . . 0.0 109.999 174.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -70.82 -10.26 59.19 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.547 -177.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 59' ' ' THR . 33.1 ptt180 -95.22 -33.3 12.65 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 122.732 0.413 . . . . 0.0 110.364 175.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.8 p -98.76 19.13 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.888 0.875 . . . . 0.0 110.107 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 61' ' ' GLU . 0.6 OUTLIER -58.09 111.83 1.32 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.413 1.085 . . . . 0.0 111.277 174.167 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -56.43 132.62 76.64 Favored Pre-proline 0 CA--C 1.558 1.276 0 C-N-CA 122.963 0.505 . . . . 0.0 111.462 166.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -79.19 128.56 16.64 Favored 'Cis proline' 0 C--N 1.375 1.973 0 C-N-CA 124.579 -1.009 . . . . 0.0 113.283 -0.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 64.9 p -153.86 157.16 38.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.1 0.96 . . . . 0.0 109.311 176.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -148.4 111.44 4.87 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 123.206 0.602 . . . . 0.0 109.88 177.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -160.83 158.4 28.33 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 172.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.7 t -93.06 166.69 12.23 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.895 0.478 . . . . 0.0 111.563 -174.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 40.4 t -84.77 107.48 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 C-N-CA 123.347 0.659 . . . . 0.0 110.173 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -96.48 -5.84 38.59 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.446 0.698 . . . . 0.0 110.823 175.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.1 m -89.36 101.27 13.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.3 0.64 . . . . 0.0 109.379 175.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.1 121.07 80.22 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 123.169 0.588 . . . . 0.0 110.619 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -75.92 71.38 5.59 Favored 'Trans proline' 0 C--N 1.379 2.166 0 C-N-CA 123.248 2.632 . . . . 0.0 110.849 170.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.3 p -74.58 82.03 2.01 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.242 1.017 . . . . 0.0 110.396 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -101.21 83.28 2.46 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.5 m -127.85 140.47 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.595 0.758 . . . . 0.0 110.478 -173.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -89.88 147.26 23.86 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.575 0.75 . . . . 0.0 109.315 178.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -104.4 25.86 24.61 Favored Glycine 0 N--CA 1.476 1.329 0 O-C-N 123.368 0.418 . . . . 0.0 112.377 175.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.7 p -84.14 94.78 8.44 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.733 0.813 . . . . 0.0 110.14 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -140.27 39.7 1.92 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.863 0.865 . . . . 0.0 109.692 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -76.34 101.06 5.36 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.584 0.754 . . . . 0.0 110.124 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.0 p-10 -138.17 101.08 4.31 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.876 0.871 . . . . 0.0 109.036 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -79.32 78.99 5.79 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.714 0.768 . . . . 0.0 109.433 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -122.36 156.09 34.66 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.974 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 38.7 t -92.05 139.75 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.477 0.711 . . . . 0.0 109.194 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.21 41.88 1.03 Allowed 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.873 0.869 . . . . 0.0 109.478 -178.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -89.29 140.4 29.53 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.396 0.679 . . . . 0.0 109.715 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.72 153.08 14.45 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.397 0.679 . . . . 0.0 109.621 178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 35.7 t -127.73 69.26 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 176.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 30.5 mm -116.41 75.84 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 175.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -79.53 76.83 6.14 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.785 179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.99 -14.91 33.0 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 124.01 0.924 . . . . 0.0 109.206 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.7 m -64.25 93.46 0.09 Allowed 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.813 0.845 . . . . 0.0 111.328 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -90.46 127.76 36.31 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.189 176.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -98.82 123.77 43.27 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 48.9 m-20 -78.14 91.3 4.31 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 176.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.6 tptm -60.47 149.6 33.81 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 124.006 0.923 . . . . 0.0 111.5 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.93 -13.38 4.39 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 126.132 1.773 . . . . 0.0 114.717 -174.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.41 -60.91 2.66 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.929 0.891 . . . . 0.0 112.559 -178.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -26.72 60.95 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.115 0.416 . . . . 0.0 111.436 -177.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -58.61 -42.75 88.87 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 109.821 -0.436 . . . . 0.0 109.821 170.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.29 -38.9 78.53 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.94 0.896 . . . . 0.0 110.726 -178.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.31 84.19 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 124.182 0.926 . . . . 0.0 111.397 178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.0 mm -67.14 -46.21 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 123.42 0.688 . . . . 0.0 110.195 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.83 -43.48 81.09 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.656 0.782 . . . . 0.0 111.216 178.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.1 tp -66.46 -52.14 49.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.479 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.8 m -68.35 -26.47 65.61 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -172.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -91.81 -36.22 13.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.651 0.38 . . . . 0.0 111.216 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.7 -1.79 56.56 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 112.451 0.538 . . . . 0.0 112.451 -176.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -73.88 -164.62 0.24 Allowed 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 121.482 0.658 . . . . 0.0 111.298 173.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 21.1 p -134.3 121.86 15.67 Favored Pre-proline 0 C--O 1.244 0.766 0 C-N-CA 123.861 0.864 . . . . 0.0 109.236 -178.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -61.7 114.56 2.32 Favored 'Trans proline' 0 C--N 1.38 2.21 0 C-N-CA 122.353 2.035 . . . . 0.0 110.68 170.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.598 ' HD3' ' H ' ' A' ' 115' ' ' LYS . 0.3 OUTLIER -87.63 16.31 5.78 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.068 0.547 . . . . 0.0 111.091 -179.042 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 49.8 mm -61.94 106.43 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 C-N-CA 123.568 0.747 . . . . 0.0 109.966 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -102.18 -40.27 6.87 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.597 0.759 . . . . 0.0 110.793 -176.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -81.73 6.55 15.01 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -170.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 60.6 92.92 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.532 1.133 . . . . 0.0 110.189 -172.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 78.58 103.17 0.21 Allowed Glycine 0 C--N 1.341 0.836 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 -166.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 74.42 142.28 0.07 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 125.772 1.629 . . . . 0.0 110.914 -174.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -89.9 -48.17 7.4 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.08 0.952 . . . . 0.0 110.753 179.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -165.3 127.03 2.04 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -144.78 145.48 31.68 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.428 0.691 . . . . 0.0 109.302 178.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 10.5 ptm85 -142.54 24.86 1.88 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.997 0.919 . . . . 0.0 109.998 -178.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.46 ' HB3' ' HG2' ' A' ' 128' ' ' GLU . 1.9 mpt? -116.22 130.52 56.83 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.348 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -94.06 17.31 12.65 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.324 0.65 . . . . 0.0 111.495 177.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.46 ' HG2' ' HB3' ' A' ' 126' ' ' MET . 12.5 pt-20 -75.21 130.67 39.54 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.125 0.57 . . . . 0.0 109.628 173.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.55 153.05 21.0 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.636 0.775 . . . . 0.0 109.291 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 22.5 m -63.34 96.3 0.11 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.096 0.559 . . . . 0.0 110.375 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -87.04 -19.27 28.87 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.919 0.888 . . . . 0.0 110.494 178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.299 0 C-N-CA 124.138 0.975 . . . . 0.0 109.376 177.524 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 119.688 -0.196 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.3 tmm? -55.48 -57.11 13.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.733 0.813 . . . . 0.0 111.205 -177.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.612 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.2 pt? -56.39 -35.59 67.92 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.463 0.705 . . . . 0.0 111.886 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.612 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -61.74 -62.81 1.54 Allowed 'General case' 0 C--N 1.358 0.963 0 C-N-CA 123.33 0.652 . . . . 0.0 109.632 178.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -64.48 -43.12 95.16 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 124.813 1.321 . . . . 0.0 111.401 -171.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.463 ' O ' HG12 ' A' ' 31' ' ' ILE . 7.1 mm100 -66.07 -52.12 51.77 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.748 -178.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.599 HD23 ' HA ' ' A' ' 40' ' ' LEU . 20.6 tp -62.5 -44.66 95.83 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 178.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -57.98 -31.33 66.8 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 124.666 1.186 . . . . 0.0 111.77 178.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -71.77 -52.2 18.84 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.313 0.645 . . . . 0.0 110.496 176.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.463 HG12 ' O ' ' A' ' 27' ' ' GLN . 15.1 pt -89.65 3.45 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -171.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.5 p -114.41 -51.25 2.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 167.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.53 -2.05 34.47 Favored Glycine 0 C--N 1.341 0.844 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.836 -175.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.532 HD12 HD13 ' A' ' 58' ' ' LEU . 81.7 mt -82.21 120.68 34.15 Favored 'Isoleucine or valine' 0 C--N 1.351 0.67 0 C-N-CA 123.579 0.751 . . . . 0.0 110.58 -176.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -79.98 -26.27 40.01 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.39 -177.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 7.4 m-20 -64.24 110.69 4.21 Favored Pre-proline 0 N--CA 1.479 1.012 0 C-N-CA 124.668 1.187 . . . . 0.0 111.225 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -65.21 -26.23 57.06 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.833 2.355 . . . . 0.0 112.378 -176.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.9 m -58.16 -52.14 66.78 Favored 'General case' 0 C--N 1.356 0.87 0 C-N-CA 123.739 0.816 . . . . 0.0 110.113 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -57.35 -37.59 72.8 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.274 0.984 . . . . 0.0 110.991 179.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.599 ' HA ' HD23 ' A' ' 28' ' ' LEU . 58.7 mt -70.7 -48.48 54.41 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 124.172 0.92 . . . . 0.0 111.486 -174.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 78.5 m-70 -68.71 -38.91 80.6 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.929 0.492 . . . . 0.0 111.23 178.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 46.4 mt-10 -68.1 -37.25 80.98 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.226 0.61 . . . . 0.0 111.754 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.43 -43.81 72.62 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 123.797 0.686 . . . . 0.0 110.685 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.523 ' HG ' ' HB2' ' A' ' 24' ' ' LEU . 3.4 mm? -62.84 -35.74 80.93 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.96 0.904 . . . . 0.0 111.03 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.574 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.2 tmmm? -68.19 -47.1 68.83 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.708 0.803 . . . . 0.0 110.464 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.09 -19.89 61.06 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.771 0.828 . . . . 0.0 111.74 -175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 85.6 p -96.67 -0.71 48.0 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.455 0.702 . . . . 0.0 111.292 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.1 t30 64.51 21.9 12.56 Favored 'General case' 0 CA--C 1.563 1.45 0 C-N-CA 124.761 1.225 . . . . 0.0 111.089 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -16.18 24.98 Favored Glycine 0 C--N 1.348 1.225 0 CA-C-N 115.978 -0.555 . . . . 0.0 113.306 176.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -76.97 102.35 6.38 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-N 117.328 0.564 . . . . 0.0 110.459 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.9 tt -60.24 -25.72 34.53 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.665 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 29.0 m -67.86 -47.78 67.94 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.15 0.58 . . . . 0.0 110.709 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.434 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 7.9 mm-40 -65.47 -34.73 78.96 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.543 0.337 . . . . 0.0 110.657 175.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.16 -42.34 90.5 Favored 'General case' 0 C--O 1.248 1.02 0 C-N-CA 123.362 0.665 . . . . 0.0 110.885 178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.9 t -59.24 -52.15 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 O-C-N 123.798 0.686 . . . . 0.0 109.723 171.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.4 m -56.76 -33.26 66.42 Favored 'General case' 0 N--CA 1.483 1.209 0 O-C-N 124.126 0.892 . . . . 0.0 112.434 -175.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -79.7 -36.17 37.96 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.567 0.747 . . . . 0.0 111.177 -178.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.532 HD13 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -76.0 -25.2 55.54 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 175.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.5 p -93.16 10.9 29.76 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.42 0.688 . . . . 0.0 111.426 179.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -52.21 -38.71 58.76 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.959 0.904 . . . . 0.0 111.277 175.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -59.24 -26.88 65.26 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.244 1.018 . . . . 0.0 113.396 -178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -104.54 -26.82 12.21 Favored 'General case' 0 N--CA 1.488 1.438 0 CA-C-N 118.121 0.419 . . . . 0.0 111.325 -178.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.1 p -102.38 9.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.078 0.551 . . . . 0.0 110.992 -175.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -67.37 100.15 0.8 Allowed 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 121.744 0.783 . . . . 0.0 110.103 175.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -76.34 151.08 83.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.484 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -78.22 158.62 93.43 Favored 'Cis proline' 0 C--N 1.383 2.361 0 CA-C-N 119.755 0.948 . . . . 0.0 113.573 4.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.3 t -152.22 124.28 8.08 Favored 'General case' 0 C--O 1.242 0.688 0 C-N-CA 123.88 0.872 . . . . 0.0 109.531 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -75.55 92.93 2.95 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.301 0.641 . . . . 0.0 109.358 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -157.05 159.76 38.27 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.878 0.871 . . . . 0.0 109.476 -177.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.2 t -62.62 107.05 0.87 Allowed 'General case' 0 CA--C 1.554 1.11 0 CA-C-O 121.893 0.854 . . . . 0.0 110.958 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.3 m -97.33 141.51 15.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 115.065 -0.971 . . . . 0.0 109.876 178.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.44 78.4 4.91 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 121.229 0.538 . . . . 0.0 109.717 178.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.1 t -108.08 129.09 55.17 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 123.698 0.799 . . . . 0.0 109.309 178.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -85.63 142.59 37.33 Favored Pre-proline 0 CA--C 1.547 0.838 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.81 179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -58.02 151.64 56.69 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 123.462 2.775 . . . . 0.0 113.79 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.3 t -141.57 143.63 33.83 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.027 0.931 . . . . 0.0 109.093 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.84 -10.73 59.78 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.01 0.524 . . . . 0.0 111.688 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.8 t -75.33 81.45 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-O 121.648 0.737 . . . . 0.0 109.462 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -98.26 169.15 9.78 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.1 0.96 . . . . 0.0 110.278 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 121.64 -32.4 4.66 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.815 -178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 42.0 p -78.72 6.46 8.87 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.963 0.905 . . . . 0.0 112.358 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.05 -25.31 62.58 Favored 'General case' 0 C--N 1.355 0.816 0 C-N-CA 123.744 0.818 . . . . 0.0 110.773 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -74.22 84.14 1.87 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.563 0.745 . . . . 0.0 111.29 -178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -99.02 -63.99 1.07 Allowed 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 174.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt 58.95 86.37 0.09 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.442 1.497 . . . . 0.0 111.291 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -103.24 48.99 0.84 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 110.041 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 22.9 m -63.2 155.53 5.4 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.262 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.7 mt -89.21 12.51 15.71 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.141 0.977 . . . . 0.0 111.1 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -93.53 117.88 30.64 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.228 1.011 . . . . 0.0 110.563 -178.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.45 166.37 31.11 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.397 1.079 . . . . 0.0 109.556 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 13.1 p -100.15 30.88 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 CA-C-O 122.155 0.979 . . . . 0.0 111.295 -174.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 50.7 mt -91.27 68.63 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -87.96 80.87 7.64 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.98 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.96 -10.41 59.46 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.357 174.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 45.1 p -59.43 -53.6 56.28 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.812 1.245 . . . . 0.0 111.37 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -106.89 89.72 3.09 Favored 'General case' 0 C--O 1.245 0.832 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 172.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -144.61 86.11 1.8 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.294 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -72.46 134.09 45.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.044 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -86.25 137.85 32.3 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.147 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -86.16 17.64 3.52 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.43 1.092 . . . . 0.0 112.053 -176.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -59.67 -66.69 0.47 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.47 1.108 . . . . 0.0 111.409 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -22.96 61.4 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.509 -178.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -58.84 -47.07 86.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 169.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -34.76 72.91 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.19 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.22 -48.05 77.33 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.474 0.71 . . . . 0.0 111.735 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.99 -41.36 59.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 123.568 0.747 . . . . 0.0 110.484 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.494 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -61.84 -51.8 66.76 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.663 0.602 . . . . 0.0 110.489 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.42 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 34.6 tp -61.33 -40.4 94.08 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.324 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.8 t -59.6 -40.02 86.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.487 0.715 . . . . 0.0 111.469 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 8.9 tt -65.27 -39.32 92.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.576 0.751 . . . . 0.0 109.645 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 60.4 mt -77.54 -24.52 49.88 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.418 0.687 . . . . 0.0 112.097 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 108' ' ' LEU . 18.5 mm-40 -75.99 -47.16 26.03 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.204 0.601 . . . . 0.0 110.397 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.5 p -70.0 133.08 88.12 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.99 175.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -68.6 146.24 66.73 Favored 'Trans proline' 0 C--N 1.374 1.884 0 C-N-CA 122.204 1.936 . . . . 0.0 111.165 175.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.32 -11.44 57.69 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.029 0.531 . . . . 0.0 109.945 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 45.8 mm -42.82 119.71 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 125.651 1.58 . . . . 0.0 111.995 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.38 -37.58 87.44 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 123.074 0.55 . . . . 0.0 111.013 -176.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -174.15 163.72 3.93 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.078 0.951 . . . . 0.0 109.702 178.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 16.1 t70 63.89 -85.25 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.463 1.105 . . . . 0.0 111.467 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -173.49 33.1 0.11 Allowed Glycine 0 C--N 1.342 0.863 0 N-CA-C 110.442 -1.063 . . . . 0.0 110.442 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.23 153.08 42.45 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.252 1.021 . . . . 0.0 110.675 -171.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -127.54 100.68 6.1 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.948 0.899 . . . . 0.0 108.815 -174.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 43.1 tp 59.38 -76.08 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.78 1.632 . . . . 0.0 112.111 -174.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 25.41 -72.37 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 128.003 2.521 . . . . 0.0 116.923 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.14 78.01 8.87 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 123.861 0.864 . . . . 0.0 109.905 -173.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 14.1 tpt -78.2 129.33 34.99 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 173.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 16.2 p80 -68.72 154.06 42.65 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.833 0.453 . . . . 0.0 109.853 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -64.03 127.86 33.29 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 122.883 0.473 . . . . 0.0 109.967 176.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -104.94 79.44 1.51 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 122.947 0.499 . . . . 0.0 109.707 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 34.4 m -110.5 112.09 23.78 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 171.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.7 m -77.14 113.63 15.09 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.515 0.726 . . . . 0.0 109.77 176.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 C-N-CA 123.88 0.872 . . . . 0.0 108.9 179.11 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 N--CA 1.485 1.31 0 N-CA-C 110.811 -0.07 . . . . 0.0 110.811 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.0 tpt -50.11 -48.69 53.34 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.382 1.073 . . . . 0.0 112.989 -172.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.528 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.2 pt? -59.17 -39.49 82.66 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.648 0.779 . . . . 0.0 112.737 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -70.54 -37.63 74.08 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.328 0.251 . . . . 0.0 110.371 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -63.85 -45.26 90.28 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 124.259 0.975 . . . . 0.0 110.211 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -62.24 -51.32 68.23 Favored 'General case' 0 C--N 1.349 0.564 0 O-C-N 124.422 1.077 . . . . 0.0 110.822 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' A' ' 40' ' ' LEU . 14.7 tp -63.79 -44.21 94.01 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.891 0.745 . . . . 0.0 110.629 -176.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.2 ttt-85 -54.25 -41.81 69.19 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.274 1.03 . . . . 0.0 110.933 175.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.1 -34.69 61.76 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.449 -174.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.3 pt -94.06 -9.08 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -176.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 72.3 p -102.37 -53.51 2.88 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 171.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 112.49 -11.44 25.94 Favored Glycine 0 N--CA 1.47 0.911 0 CA-C-N 114.989 -1.005 . . . . 0.0 111.243 -172.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.477 HD12 HD13 ' A' ' 58' ' ' LEU . 78.9 mt -73.95 118.82 20.06 Favored 'Isoleucine or valine' 0 C--N 1.353 0.73 0 C-N-CA 124.085 0.954 . . . . 0.0 110.151 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -85.04 -22.5 28.98 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.963 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -62.39 111.87 5.45 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.866 0.866 . . . . 0.0 110.688 -178.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -62.47 -32.75 80.36 Favored 'Trans proline' 0 C--N 1.383 2.37 0 C-N-CA 122.894 2.396 . . . . 0.0 112.509 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 52.2 m -54.47 -50.8 66.87 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.638 0.775 . . . . 0.0 110.79 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -57.0 -37.84 72.23 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.233 1.013 . . . . 0.0 111.146 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.615 ' HA ' HD23 ' A' ' 28' ' ' LEU . 40.5 mt -72.63 -50.85 22.43 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 114.777 -1.102 . . . . 0.0 111.293 -173.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -60.74 -44.97 96.02 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.477 0.711 . . . . 0.0 111.205 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.406 ' HA ' ' HG2' ' A' ' 45' ' ' LYS . 44.0 mt-10 -66.02 -36.5 83.42 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.014 0.926 . . . . 0.0 112.086 -178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.8 -41.94 70.95 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.125 0.265 . . . . 0.0 110.423 176.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HG ' HD12 ' A' ' 24' ' ' LEU . 2.4 mm? -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.945 0.898 . . . . 0.0 110.59 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HG2' ' HA ' ' A' ' 42' ' ' GLU . 54.6 pttt -77.29 -32.23 55.31 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 122.549 0.339 . . . . 0.0 110.506 -174.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.67 -24.98 60.05 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.013 0.525 . . . . 0.0 111.187 178.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.416 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 88.4 p -93.26 3.28 55.91 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.771 0.828 . . . . 0.0 111.217 175.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.7 t30 72.04 7.2 5.75 Favored 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 125.348 1.459 . . . . 0.0 112.041 178.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.05 21.47 4.51 Favored Glycine 0 N--CA 1.473 1.148 0 C-N-CA 123.578 0.609 . . . . 0.0 112.106 177.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -104.38 116.5 32.24 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.402 0.681 . . . . 0.0 109.462 -174.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 7.8 tp -65.39 -32.88 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.365 0 C-N-CA 123.154 0.582 . . . . 0.0 111.888 -175.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -75.52 -41.66 54.57 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.697 0.799 . . . . 0.0 111.379 -175.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.416 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 16.1 mm100 -75.1 -27.65 59.94 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 122.351 -0.218 . . . . 0.0 110.59 176.141 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -66.24 -48.29 71.0 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 123.227 0.611 . . . . 0.0 111.256 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 13.7 p -65.84 -34.4 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.713 0.405 . . . . 0.0 109.998 176.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.0 t -63.5 -39.2 93.82 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 123.806 0.691 . . . . 0.0 111.524 176.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.25 -31.92 66.22 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.421 0.689 . . . . 0.0 111.518 179.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.477 HD13 HD12 ' A' ' 34' ' ' ILE . 57.7 mt -81.84 -26.8 33.96 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 112.216 0.451 . . . . 0.0 112.216 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.8 p -92.81 -0.03 57.33 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 117.987 0.358 . . . . 0.0 110.968 175.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -51.64 -40.07 59.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.151 0.98 . . . . 0.0 111.793 174.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -56.31 -41.54 76.15 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.408 1.083 . . . . 0.0 112.951 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -88.35 -35.24 17.28 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.688 0.395 . . . . 0.0 110.708 -175.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.9 p -94.59 20.55 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.234 0 C-N-CA 123.427 0.691 . . . . 0.0 110.242 -178.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -64.9 93.24 0.11 Allowed 'General case' 0 C--N 1.354 0.789 0 C-N-CA 124.334 1.054 . . . . 0.0 109.982 -176.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.527 ' HA ' ' N ' ' A' ' 67' ' ' SER . 1.5 pp20? -65.22 140.91 98.03 Favored Pre-proline 0 CA--C 1.554 1.121 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.612 -176.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -75.32 100.4 0.3 Allowed 'Cis proline' 0 C--N 1.385 2.471 0 CA-C-N 120.036 1.049 . . . . 0.0 112.386 -1.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.527 ' N ' ' HA ' ' A' ' 65' ' ' GLU . 42.4 t -86.72 -64.52 1.14 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.921 0.888 . . . . 0.0 108.803 -179.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -83.0 123.07 29.1 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 173.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -75.55 -29.52 59.42 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.576 0.35 . . . . 0.0 110.257 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 49.2 m -78.8 97.93 6.11 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 121.047 0.451 . . . . 0.0 109.796 172.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 10.5 m -136.11 155.16 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.102 0.961 . . . . 0.0 110.14 176.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -139.0 9.06 2.54 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.555 171.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.5 m -79.05 100.8 7.51 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.126 0.97 . . . . 0.0 110.326 -176.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.63 124.19 49.32 Favored Pre-proline 0 N--CA 1.48 1.048 0 C-N-CA 123.8 0.84 . . . . 0.0 110.412 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -76.25 134.94 16.32 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.079 1.852 . . . . 0.0 111.882 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 13.9 t -78.73 84.47 4.81 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 121.671 0.748 . . . . 0.0 109.38 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -132.1 25.7 4.57 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.375 -176.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 11.0 t -106.77 34.1 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-O 122.353 1.073 . . . . 0.0 109.319 -172.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -80.44 146.55 31.37 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.901 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 71.64 13.33 74.67 Favored Glycine 0 C--N 1.346 1.107 0 CA-C-N 116.05 -0.523 . . . . 0.0 113.22 -177.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.4 t -87.28 -0.2 56.38 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.746 0.818 . . . . 0.0 111.195 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -85.22 50.23 1.91 Allowed 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.815 0.846 . . . . 0.0 109.817 178.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -115.81 138.0 51.55 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 124.556 1.143 . . . . 0.0 109.314 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -126.43 143.2 51.26 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.1 tptp -164.61 110.15 0.98 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.194 0.598 . . . . 0.0 109.713 173.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -126.5 167.25 15.86 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.477 1.111 . . . . 0.0 108.947 175.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.0 m -92.38 167.91 1.57 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.889 0 CA-C-O 120.97 0.414 . . . . 0.0 110.362 173.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.34 83.03 1.41 Allowed 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 170.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.77 76.44 1.58 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.93 0.892 . . . . 0.0 112.224 -172.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.522 ' H ' ' HD3' ' A' ' 90' ' ' LYS . 0.3 OUTLIER -59.79 152.87 21.93 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 114.647 -1.16 . . . . 0.0 110.421 166.297 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.468 HG23 ' HB3' ' A' ' 93' ' ' ASP . 29.5 m -113.15 27.74 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 122.951 0.5 . . . . 0.0 110.93 -177.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.6 mt 55.21 25.11 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 125.565 1.546 . . . . 0.0 110.962 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.468 ' HB3' HG23 ' A' ' 91' ' ' VAL . 6.1 p-10 -65.68 94.85 0.21 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.652 1.181 . . . . 0.0 112.243 -171.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 9.1 tt 74.13 -29.78 0.2 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.574 1.549 . . . . 0.0 112.598 178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.3 t -63.87 103.91 0.63 Allowed 'General case' 0 CA--C 1.556 1.183 0 CA-C-O 122.282 1.039 . . . . 0.0 112.35 -171.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -138.99 121.82 16.54 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 124.466 1.107 . . . . 0.0 108.253 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -80.29 75.8 7.1 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -77.46 145.74 36.9 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 115.383 -0.826 . . . . 0.0 108.999 174.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -67.32 155.67 38.32 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.634 0.584 . . . . 0.0 110.712 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -71.99 2.81 5.07 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 124.682 1.193 . . . . 0.0 112.604 178.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -53.25 -58.51 6.81 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.116 1.366 . . . . 0.0 112.567 -173.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -34.28 76.99 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.164 -179.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -62.42 -39.38 93.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.596 0.758 . . . . 0.0 110.577 175.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.66 -42.46 67.5 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 124.253 0.971 . . . . 0.0 110.747 -175.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.43 -45.57 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.988 0.805 . . . . 0.0 111.295 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.8 mm -65.42 -46.24 90.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.321 0.649 . . . . 0.0 110.467 177.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.8 78.34 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.539 0.735 . . . . 0.0 111.224 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.98 -47.41 74.63 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.7 m -69.26 -24.46 63.98 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -177.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -83.64 -44.45 14.53 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.187 0.595 . . . . 0.0 111.429 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -76.8 -55.86 5.12 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -82.59 125.24 30.94 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.65 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.6 m -97.79 147.78 33.53 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 123.845 0.858 . . . . 0.0 109.713 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.04 142.19 86.68 Favored 'Trans proline' 0 C--N 1.376 1.977 0 C-N-CA 122.36 2.04 . . . . 0.0 111.851 176.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.18 -20.91 63.09 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.278 0.561 . . . . 0.0 110.481 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 14.6 mt -117.24 60.72 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 170.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -78.53 -36.62 44.54 Favored 'General case' 0 N--CA 1.482 1.134 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.573 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -157.93 90.13 1.05 Allowed 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.8 t70 57.31 38.83 28.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 124.516 1.126 . . . . 0.0 110.55 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -74.46 -106.03 0.09 OUTLIER Glycine 0 C--N 1.35 1.334 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.487 -176.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 12.4 mmm180 -91.44 27.64 1.91 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.185 0.594 . . . . 0.0 110.971 -178.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.81 -42.41 95.01 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.101 0.961 . . . . 0.0 111.733 -173.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 46.5 tp 67.24 78.43 0.25 Allowed 'General case' 0 C--O 1.242 0.705 0 O-C-N 124.944 1.403 . . . . 0.0 110.303 -173.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -107.48 90.73 3.39 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.189 173.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.405 ' HA ' ' HD3' ' A' ' 125' ' ' ARG . 20.2 mmt180 -139.25 -175.8 4.3 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.262 1.025 . . . . 0.0 109.956 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.28 169.02 21.74 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.773 0.829 . . . . 0.0 109.083 179.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.04 142.89 23.84 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -130.13 125.12 34.3 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.463 0.705 . . . . 0.0 109.511 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -172.09 122.35 0.48 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.34 1.456 . . . . 0.0 108.492 175.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 6.2 t -78.01 81.51 4.4 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-O 122.422 1.106 . . . . 0.0 110.593 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 26.8 m -73.81 107.79 6.26 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.292 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.552 1.03 0 C-N-CA 123.65 0.78 . . . . 0.0 110.348 -176.184 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 119.262 -0.399 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 51.7 ttm -53.4 -57.66 9.84 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.987 0.915 . . . . 0.0 111.814 -177.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.0 pt? -57.05 -34.98 68.8 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.738 0.815 . . . . 0.0 112.08 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -64.76 -51.88 59.97 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 122.859 0.464 . . . . 0.0 110.069 178.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -62.47 -49.86 73.74 Favored 'General case' 0 N--CA 1.484 1.229 0 O-C-N 124.688 1.242 . . . . 0.0 110.498 -174.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -55.24 -54.96 36.78 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.793 178.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' A' ' 40' ' ' LEU . 14.6 tp -70.73 -40.78 72.56 Favored 'General case' 0 C--N 1.354 0.78 0 O-C-N 123.342 0.401 . . . . 0.0 111.024 -175.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -54.91 -38.05 67.13 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.179 0.992 . . . . 0.0 111.272 176.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -75.71 -42.07 51.81 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.877 -177.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 28' ' ' LEU . 27.7 pt -86.23 -10.15 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.454 HG22 HG23 ' A' ' 55' ' ' VAL . 77.6 p -103.77 -50.84 3.31 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.428 0.632 . . . . 0.0 109.868 173.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.52 -4.61 32.9 Favored Glycine 0 CA--C 1.526 0.779 0 CA-C-N 114.688 -1.142 . . . . 0.0 111.541 -174.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.538 HD12 HD13 ' A' ' 58' ' ' LEU . 73.8 mt -81.0 118.8 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 124.263 1.025 . . . . 0.0 110.4 -177.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -84.12 -18.65 36.13 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.054 -178.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 13.9 t70 -69.06 119.61 71.09 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 123.53 0.732 . . . . 0.0 110.27 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -69.29 -29.58 25.9 Favored 'Trans proline' 0 C--N 1.379 2.173 0 C-N-CA 122.766 2.311 . . . . 0.0 113.287 -175.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 8.9 m -63.34 -48.72 76.82 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.086 0.554 . . . . 0.0 110.242 -176.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -55.46 -38.62 69.31 Favored 'General case' 0 N--CA 1.482 1.146 0 O-C-N 124.257 0.973 . . . . 0.0 111.454 177.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.591 ' HA ' HD23 ' A' ' 28' ' ' LEU . 45.5 mt -69.57 -46.87 65.38 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 123.872 0.733 . . . . 0.0 110.89 -177.102 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.12 -43.39 98.53 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.191 0.596 . . . . 0.0 111.267 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.516 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 49.2 mt-10 -70.75 -30.39 66.89 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.612 0.765 . . . . 0.0 111.833 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.58 -42.99 60.86 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 123.379 0.424 . . . . 0.0 110.347 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.463 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -66.19 -29.8 70.15 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.826 0.85 . . . . 0.0 110.21 176.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.516 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.3 tmmm? -75.21 -43.28 52.72 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.893 0.877 . . . . 0.0 110.48 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.61 -34.15 77.25 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.331 0.652 . . . . 0.0 110.738 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.9 p -88.53 -6.74 57.4 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.46 0.704 . . . . 0.0 111.405 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 66.48 13.18 9.15 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 125.083 1.353 . . . . 0.0 111.825 178.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.01 -14.79 5.42 Favored Glycine 0 C--N 1.351 1.394 0 CA-C-O 119.744 -0.476 . . . . 0.0 113.489 177.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -78.27 102.49 7.67 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 117.197 0.499 . . . . 0.0 109.935 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 19.1 tt -65.04 -27.01 41.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.23 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -174.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.5 m -68.26 -41.94 80.34 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 121.428 0.633 . . . . 0.0 110.348 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 -72.27 -33.24 67.32 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.4 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.98 -51.05 70.88 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 123.541 0.736 . . . . 0.0 111.386 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.454 HG23 HG22 ' A' ' 32' ' ' THR . 7.7 p -64.01 -39.81 86.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.195 176.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.2 t -60.23 -33.22 71.96 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.525 0.516 . . . . 0.0 111.905 178.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 99.3 mt -77.93 -36.28 49.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.001 0.52 . . . . 0.0 111.522 179.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.538 HD13 HD12 ' A' ' 34' ' ' ILE . 73.2 mt -78.32 -18.44 55.19 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.465 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 70.6 p -104.47 11.04 34.94 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.205 0.602 . . . . 0.0 111.008 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.89 -27.73 69.35 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.792 0.837 . . . . 0.0 111.616 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.11 -30.05 62.13 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 115.196 -0.911 . . . . 0.0 112.748 -177.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.465 ' HG2' ' O ' ' A' ' 59' ' ' THR . 13.0 ptm180 -89.65 -8.75 51.78 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.3 p -124.3 79.59 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.998 0 CA-C-O 122.503 1.144 . . . . 0.0 109.386 174.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.46 ' HB2' ' NZ ' ' A' ' 64' ' ' LYS . 2.5 ttmp? -166.16 102.64 0.64 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-N 114.342 -1.299 . . . . 0.0 109.014 178.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -69.06 160.27 79.23 Favored Pre-proline 0 CA--C 1.566 1.567 0 C-N-CA 124.02 0.928 . . . . 0.0 111.383 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -88.9 102.49 0.34 Allowed 'Cis proline' 0 C--N 1.384 2.399 0 CA-C-N 120.138 1.085 . . . . 0.0 113.29 -5.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 42.2 m -67.77 -47.59 68.77 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 170.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -93.53 118.08 30.9 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.934 176.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -75.01 129.85 38.34 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.3 t -165.25 168.6 16.85 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.832 0.853 . . . . 0.0 109.382 -174.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.8 m -74.39 144.85 11.9 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 167.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -97.51 21.4 10.28 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.506 0.722 . . . . 0.0 111.046 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.6 m 65.89 28.57 10.66 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 125.014 1.325 . . . . 0.0 110.892 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.43 154.28 62.53 Favored Pre-proline 0 CA--C 1.554 1.107 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.619 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.0 -168.7 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.746 0 C-N-CA 122.409 2.073 . . . . 0.0 112.826 176.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.1 t -69.82 93.13 0.72 Allowed 'General case' 0 N--CA 1.477 0.9 0 CA-C-O 121.259 0.552 . . . . 0.0 110.834 -177.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -86.9 -17.79 32.4 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.836 0.854 . . . . 0.0 110.897 177.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 87.1 t -74.39 123.75 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 172.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.91 159.66 22.09 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.942 0.897 . . . . 0.0 111.445 -174.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -116.01 87.37 0.44 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 114.952 -1.022 . . . . 0.0 110.606 173.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.2 m -53.37 141.59 24.02 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.816 0.846 . . . . 0.0 111.977 176.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -83.1 71.7 10.14 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 123.685 0.794 . . . . 0.0 108.898 176.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -62.04 -31.07 71.43 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.191 176.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 59.96 58.34 2.77 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.956 1.302 . . . . 0.0 112.019 170.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -102.99 130.25 50.02 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.018 171.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -71.53 145.39 49.16 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.984 0.913 . . . . 0.0 111.566 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 30.1 m -81.81 150.29 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.924 0.49 . . . . 0.0 110.459 173.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.2 pp -108.78 29.96 6.96 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.618 0.767 . . . . 0.0 110.901 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -85.83 153.0 22.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.711 0.804 . . . . 0.0 110.203 -178.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 148.85 38.9 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.418 0.687 . . . . 0.0 109.715 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.1 p -122.91 24.66 3.91 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 CA-C-O 121.293 0.568 . . . . 0.0 110.798 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 46.6 mm 50.06 70.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 CA-C-O 122.855 1.312 . . . . 0.0 109.353 -172.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -120.31 29.87 7.26 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 113.509 -1.678 . . . . 0.0 110.152 -172.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.1 pp -87.49 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.663 1.185 . . . . 0.0 111.415 -175.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.6 p -68.3 127.85 34.45 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.743 0.817 . . . . 0.0 110.628 -179.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -91.34 146.15 24.05 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.462 0.705 . . . . 0.0 110.685 -175.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -64.64 156.8 28.96 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.529 175.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.421 HD22 ' NE2' ' A' ' 103' ' ' GLN . 4.2 p-10 -68.22 117.62 10.27 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.734 0.814 . . . . 0.0 110.258 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.554 ' HG3' ' H ' ' A' ' 101' ' ' ASP . 17.4 tppt? -62.16 144.26 55.65 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.993 0.917 . . . . 0.0 111.461 -173.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.55 0.77 13.78 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.445 1.098 . . . . 0.0 112.596 -177.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.554 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 21.0 t70 -54.38 -70.51 0.1 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.8 1.24 . . . . 0.0 111.906 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -30.52 69.53 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.225 0.61 . . . . 0.0 112.053 -176.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.421 ' NE2' HD22 ' A' ' 98' ' ' ASN . 47.2 mt-30 -65.62 -48.24 72.92 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.028 0.531 . . . . 0.0 110.158 179.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.04 70.35 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.626 0.579 . . . . 0.0 111.12 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -56.16 20.05 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.085 0.554 . . . . 0.0 111.013 178.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -72.8 -41.92 61.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 123.324 0.65 . . . . 0.0 110.673 -175.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.93 -43.35 96.15 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.944 0.498 . . . . 0.0 111.554 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 112' ' ' GLU . 54.5 tp -63.6 -46.68 84.7 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 176.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -59.37 -24.73 63.65 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.17 0.588 . . . . 0.0 112.406 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.78 -44.4 49.73 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.75 -8.75 59.44 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.888 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 108' ' ' LEU . 12.2 mm-40 -68.26 149.06 49.93 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.052 0.453 . . . . 0.0 110.139 173.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.2 m -115.85 155.29 47.91 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.111 0.964 . . . . 0.0 110.41 -171.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.79 131.11 35.84 Favored 'Trans proline' 0 C--N 1.381 2.262 0 C-N-CA 122.051 1.834 . . . . 0.0 110.946 172.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -67.44 -45.15 76.87 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 116' ' ' ILE . 2.2 mp -86.29 114.76 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 168.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -56.18 -33.87 65.68 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.938 0.895 . . . . 0.0 113.366 -171.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.548 ' O ' ' HG2' ' A' ' 121' ' ' ARG . . . -81.94 84.56 6.9 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 122.864 0.466 . . . . 0.0 110.363 175.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 63.12 3.05 1.18 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 124.858 1.263 . . . . 0.0 114.029 170.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 74.19 64.4 2.42 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 117.933 0.333 . . . . 0.0 112.921 -173.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.548 ' HG2' ' O ' ' A' ' 118' ' ' ALA . 31.2 mmt180 -83.57 37.74 0.59 Allowed 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 123.303 0.641 . . . . 0.0 111.911 176.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -55.06 -37.25 66.51 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.893 0.877 . . . . 0.0 112.373 176.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.4 tt -138.99 72.8 1.41 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.253 -1.388 . . . . 0.0 107.253 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -164.54 163.93 21.86 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 114.546 -1.207 . . . . 0.0 108.672 178.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 29.3 mmm180 63.02 28.48 16.23 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.558 1.143 . . . . 0.0 111.68 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.6 ptm -90.82 5.1 49.8 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.83 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -151.45 154.39 36.5 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.496 0.719 . . . . 0.0 110.106 176.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.498 ' HG2' HG22 ' A' ' 130' ' ' THR . 41.6 tt0 -162.77 105.56 1.07 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 0.0 108.413 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -82.03 92.47 6.8 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.979 0.511 . . . . 0.0 110.882 -177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . 0.498 HG22 ' HG2' ' A' ' 128' ' ' GLU . 12.6 t -170.33 174.4 5.28 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.946 0.898 . . . . 0.0 110.165 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 32.8 m -103.9 142.55 34.21 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.733 0.813 . . . . 0.0 110.418 -177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.96 0 C-N-CA 124.099 0.96 . . . . 0.0 109.223 179.393 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 30.3 tp60 . . . . . 0 N--CA 1.48 1.027 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.7 ttt -55.52 -48.41 74.71 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.721 0.808 . . . . 0.0 112.233 -172.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.574 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -56.67 -38.86 72.79 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.728 0.811 . . . . 0.0 112.27 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.574 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.7 mm? -65.3 -46.11 81.71 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -63.23 -44.74 94.39 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 124.418 1.074 . . . . 0.0 111.271 -177.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -55.55 33.4 Favored 'General case' 0 C--N 1.349 0.55 0 O-C-N 124.532 1.145 . . . . 0.0 110.075 179.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.682 HD23 ' HA ' ' A' ' 40' ' ' LEU . 13.8 tp -66.61 -44.9 80.86 Favored 'General case' 0 C--N 1.351 0.665 0 O-C-N 124.213 0.946 . . . . 0.0 111.125 -174.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -56.93 -38.8 73.39 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.419 1.088 . . . . 0.0 111.605 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -71.62 -49.62 38.46 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.753 0.658 . . . . 0.0 110.641 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.488 HD11 HD12 ' A' ' 28' ' ' LEU . 14.6 pt -74.93 -30.21 23.5 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -173.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.3 p -87.2 -48.21 8.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.892 0.477 . . . . 0.0 110.152 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.37 4.92 54.82 Favored Glycine 0 CA--C 1.526 0.753 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.665 -174.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.64 HD12 HD13 ' A' ' 58' ' ' LEU . 72.7 mt -84.85 124.8 40.19 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 C-N-CA 123.865 0.866 . . . . 0.0 110.463 -177.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -90.21 -12.25 38.61 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.247 1.019 . . . . 0.0 112.61 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.417 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 8.0 m-20 -72.05 109.09 5.03 Favored Pre-proline 0 N--CA 1.475 0.816 0 O-C-N 123.787 0.68 . . . . 0.0 109.688 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -63.73 -28.64 68.64 Favored 'Trans proline' 0 C--N 1.385 2.47 0 C-N-CA 123.0 2.466 . . . . 0.0 111.413 -177.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.3 m -58.28 -51.98 67.49 Favored 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.118 0.967 . . . . 0.0 110.537 176.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.4 m-30 -60.05 -34.42 73.38 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.718 0.807 . . . . 0.0 111.263 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.682 ' HA ' HD23 ' A' ' 28' ' ' LEU . 51.9 mt -69.88 -52.38 25.25 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.778 -177.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -57.04 -49.84 74.6 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.751 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.4 -38.91 91.47 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.387 0.675 . . . . 0.0 112.373 -173.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.62 -42.2 82.74 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.462 0.476 . . . . 0.0 110.809 176.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.433 HD23 HD22 ' A' ' 28' ' ' LEU . 3.7 mm? -63.76 -32.8 74.42 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.856 0.862 . . . . 0.0 111.31 175.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.3 mpmm? -75.75 -41.61 52.76 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 122.836 0.454 . . . . 0.0 110.461 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.29 -27.28 67.04 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.07 0.948 . . . . 0.0 111.14 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 39.6 m -101.83 -1.63 31.8 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.792 0.837 . . . . 0.0 111.705 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 10.5 m120 64.68 16.97 10.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.964 1.306 . . . . 0.0 112.283 178.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.76 -13.57 13.1 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-O 119.51 -0.605 . . . . 0.0 113.126 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.4 109.05 5.14 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.007 0.523 . . . . 0.0 109.773 -178.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 9.3 tp -66.76 -28.94 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.591 0.756 . . . . 0.0 111.601 -172.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.7 m -71.85 -45.34 61.75 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.092 -177.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.413 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 18.8 mm-40 -65.45 -40.44 93.23 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 122.876 0.471 . . . . 0.0 110.158 174.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.98 -50.1 75.35 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.008 0.923 . . . . 0.0 111.869 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 14.2 p -64.73 -39.31 85.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.661 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.533 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.8 m -62.34 -36.55 82.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.384 0.673 . . . . 0.0 112.242 178.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.4 mt -71.64 -33.81 69.24 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.448 0.699 . . . . 0.0 111.007 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.64 HD13 HD12 ' A' ' 34' ' ' ILE . 79.6 mt -84.08 -26.68 28.82 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 176.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.436 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 82.8 p -96.27 12.59 30.47 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.098 0.559 . . . . 0.0 110.799 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -66.02 -17.74 64.88 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 123.903 0.881 . . . . 0.0 110.517 169.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.36 -27.9 61.75 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.554 1.141 . . . . 0.0 112.201 -177.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 59' ' ' THR . 37.3 ptt180 -61.79 -32.26 72.53 Favored 'General case' 0 N--CA 1.496 1.83 0 CA-C-O 121.448 0.642 . . . . 0.0 110.316 176.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.5 p -119.3 32.57 1.77 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 124.821 1.248 . . . . 0.0 108.66 -175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -61.09 89.46 0.02 OUTLIER 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.069 0.948 . . . . 0.0 110.214 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -61.92 128.42 90.58 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 124.206 1.002 . . . . 0.0 110.958 -173.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -84.04 106.42 0.86 Allowed 'Cis proline' 0 C--N 1.381 2.281 0 C-N-CA 124.982 -0.841 . . . . 0.0 113.618 3.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 32.9 t -104.5 143.2 33.36 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.605 0.762 . . . . 0.0 109.742 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.04 -10.73 12.82 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.739 0.816 . . . . 0.0 111.447 175.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -59.91 -49.65 76.84 Favored 'General case' 0 C--N 1.362 1.121 0 C-N-CA 123.534 0.733 . . . . 0.0 110.29 176.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.0 p -110.3 142.9 41.28 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 166.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.6 t -67.62 102.15 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.718 0 N-CA-C 109.047 -0.724 . . . . 0.0 109.047 175.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -76.21 68.28 2.6 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.051 0.94 . . . . 0.0 110.109 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.2 m -147.47 97.52 2.86 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 124.493 1.117 . . . . 0.0 108.404 -178.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -112.32 159.55 33.53 Favored Pre-proline 0 CA--C 1.549 0.929 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 175.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_exo -47.1 106.99 0.11 Allowed 'Trans proline' 0 C--N 1.384 2.425 0 C-N-CA 123.466 2.777 . . . . 0.0 112.827 176.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.5 m -76.78 82.84 3.38 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.704 0.764 . . . . 0.0 110.004 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.27 17.44 16.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.886 1.274 . . . . 0.0 109.704 -177.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 18.7 m -58.11 134.62 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 C-N-CA 124.574 1.15 . . . . 0.0 112.039 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.97 107.93 10.87 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.191 0.596 . . . . 0.0 109.583 -177.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.99 82.68 0.54 Allowed Glycine 0 C--N 1.339 0.733 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.83 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.0 t -68.76 140.21 55.33 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.434 0.694 . . . . 0.0 110.727 178.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -126.16 77.39 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 C-N-CA 123.761 0.824 . . . . 0.0 109.702 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -97.26 38.4 1.26 Allowed 'General case' 0 N--CA 1.478 0.927 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.909 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -61.66 120.2 10.16 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.407 1.083 . . . . 0.0 111.249 -174.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -155.63 136.4 13.5 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 175.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -125.67 133.97 52.0 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.3 m -69.23 159.84 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 123.19 0.596 . . . . 0.0 111.117 -179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 9.1 mp -89.27 19.64 4.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.717 0.807 . . . . 0.0 110.562 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -91.77 117.11 29.47 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 123.965 0.906 . . . . 0.0 109.671 176.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.404 ' HG2' ' H ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -160.1 168.05 26.39 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.843 0.857 . . . . 0.0 109.139 -178.1 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.46 5.91 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 CA-C-O 121.856 0.836 . . . . 0.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.404 ' H ' ' HG2' ' A' ' 90' ' ' LYS . 35.0 mt -89.46 72.52 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 124.304 1.042 . . . . 0.0 108.948 -173.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -93.73 147.06 23.39 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 114.354 -1.294 . . . . 0.0 109.246 175.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -148.26 39.96 0.93 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 123.378 0.671 . . . . 0.0 111.681 -179.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 37.8 p -74.27 -64.27 1.06 Allowed 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.922 0.489 . . . . 0.0 111.858 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 44.9 m-70 -98.27 18.23 16.82 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.222 0.609 . . . . 0.0 110.926 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -82.62 60.31 5.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.811 0.845 . . . . 0.0 110.788 179.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -108.76 131.45 54.94 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 174.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.534 ' HG3' ' H ' ' A' ' 101' ' ' ASP . 26.7 tptp -79.12 145.58 33.66 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 122.941 0.496 . . . . 0.0 110.063 -176.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -77.22 -6.05 51.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.754 0.821 . . . . 0.0 111.586 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.534 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 26.7 t70 -59.45 -66.73 0.46 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.198 0.999 . . . . 0.0 111.052 -179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.428 ' H ' HD13 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -66.47 -32.46 73.84 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 124.297 0.998 . . . . 0.0 111.704 -178.292 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -58.7 -57.32 13.54 Favored 'General case' 0 C--N 1.359 0.99 0 O-C-N 123.877 0.736 . . . . 0.0 110.368 176.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -72.82 -25.44 61.14 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 124.45 1.094 . . . . 0.0 111.386 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.81 -57.96 8.28 Favored 'General case' 0 C--N 1.354 0.779 0 C-N-CA 123.135 0.574 . . . . 0.0 110.156 176.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.26 -39.89 81.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.546 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.439 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -54.6 -59.1 5.16 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 124.021 0.928 . . . . 0.0 110.82 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 43.9 tp -67.73 -34.39 76.75 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.119 0.887 . . . . 0.0 111.398 -177.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.1 t -66.4 -30.16 70.48 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 122.381 0.272 . . . . 0.0 111.443 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 43.3 mt -83.48 -24.6 31.68 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.769 0.828 . . . . 0.0 110.96 175.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 87.2 mt -77.07 -19.67 56.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.186 0.594 . . . . 0.0 110.475 170.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -110.34 25.75 11.44 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.482 1.113 . . . . 0.0 109.947 176.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 33.9 p -54.85 120.79 30.78 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.555 0.742 . . . . 0.0 110.542 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.02 152.61 69.97 Favored 'Trans proline' 0 C--N 1.376 2.0 0 C-N-CA 122.969 2.446 . . . . 0.0 112.613 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? -86.63 11.34 13.09 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.356 0.662 . . . . 0.0 110.111 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.464 HD12 ' HA ' ' A' ' 122' ' ' ASP . 5.6 tt -135.16 105.27 5.6 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 C-N-CA 124.861 1.264 . . . . 0.0 108.468 175.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -107.75 -24.89 11.52 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.707 0.803 . . . . 0.0 109.749 173.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -152.65 72.38 0.97 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.321 1.048 . . . . 0.0 109.16 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 62.7 28.3 16.49 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.603 1.161 . . . . 0.0 112.276 176.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.91 -104.19 0.02 OUTLIER Glycine 0 C--N 1.359 1.827 0 CA-C-O 120.007 -0.329 . . . . 0.0 112.675 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 39.1 mmt180 -84.04 81.84 8.61 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.616 0.722 . . . . 0.0 109.059 175.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.464 ' HA ' HD12 ' A' ' 116' ' ' ILE . 31.6 t70 -62.01 -35.02 77.31 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.204 -1.362 . . . . 0.0 111.193 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.6 pp -64.21 -22.23 66.87 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.378 0.671 . . . . 0.0 112.389 178.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -79.32 90.49 4.98 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 175.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -156.5 170.08 23.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.678 1.191 . . . . 0.0 108.855 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 43.2 tpp -150.08 128.21 11.97 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.165 0.586 . . . . 0.0 110.264 -177.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -129.56 105.91 8.39 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.279 1.031 . . . . 0.0 108.577 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.45 -165.85 2.33 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.1 0.96 . . . . 0.0 109.684 177.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.46 75.0 4.02 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 123.322 0.649 . . . . 0.0 111.879 -177.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 5.2 t -104.32 90.01 3.42 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 121.657 0.741 . . . . 0.0 109.143 171.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.4 t -165.08 154.94 13.26 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.396 0.678 . . . . 0.0 109.759 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 C-N-CA 123.785 0.834 . . . . 0.0 109.152 178.155 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 110.657 -0.127 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.0 tpt -52.61 -52.39 55.58 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.22 1.008 . . . . 0.0 111.951 -173.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.507 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.5 pt? -62.54 -33.54 75.13 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.057 0.943 . . . . 0.0 112.995 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.2 -49.45 71.95 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.164 0.586 . . . . 0.0 109.938 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -69.3 -42.33 75.59 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 114.35 -1.296 . . . . 0.0 110.73 -174.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -56.26 -54.34 46.49 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.364 1.065 . . . . 0.0 110.727 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.521 HD23 ' HA ' ' A' ' 40' ' ' LEU . 15.2 tp -65.08 -42.2 94.34 Favored 'General case' 0 C--N 1.357 0.922 0 O-C-N 123.496 0.498 . . . . 0.0 111.285 -177.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.6 ttt180 -57.29 -37.63 72.71 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 124.209 1.004 . . . . 0.0 111.4 178.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.45 -48.37 56.27 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.336 0.654 . . . . 0.0 111.161 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 17.7 pt -82.51 -16.18 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -172.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 74.9 p -96.05 -48.01 5.86 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.111 0.481 . . . . 0.0 109.874 173.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 105.0 -9.87 47.33 Favored Glycine 0 N--CA 1.468 0.816 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.026 -173.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.422 HD12 ' HB3' ' A' ' 58' ' ' LEU . 88.1 mt -75.85 112.11 13.11 Favored 'Isoleucine or valine' 0 C--N 1.348 0.538 0 C-N-CA 124.202 1.001 . . . . 0.0 110.351 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 20.3 mm-40 -79.49 -14.92 58.57 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.87 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 9.4 t70 -78.17 116.33 58.03 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 124.07 0.948 . . . . 0.0 110.336 -175.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -69.01 -23.43 34.21 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.924 2.416 . . . . 0.0 113.456 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 10.0 m -62.31 -50.15 72.77 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.073 0.549 . . . . 0.0 110.061 -177.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.8 -38.36 78.42 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 125.112 1.507 . . . . 0.0 111.318 179.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 28' ' ' LEU . 43.1 mt -67.67 -46.55 72.03 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 124.199 0.937 . . . . 0.0 111.111 -176.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 85.6 m-70 -62.27 -46.06 90.49 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.667 0.604 . . . . 0.0 111.022 176.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.509 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 47.2 mt-10 -65.15 -31.2 72.27 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.497 0.719 . . . . 0.0 112.16 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.96 -43.81 64.58 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 123.676 0.61 . . . . 0.0 110.43 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.507 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.2 mm? -68.58 -27.05 65.72 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 0.0 110.349 176.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.509 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.7 tmmm? -75.38 -45.2 40.62 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.255 1.022 . . . . 0.0 110.309 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.22 -30.29 68.42 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.443 0.697 . . . . 0.0 111.274 -177.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 82.9 p -91.08 2.79 56.06 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.724 0.81 . . . . 0.0 112.123 -177.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 67.65 11.74 8.52 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 124.842 1.257 . . . . 0.0 111.866 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.05 2.25 22.08 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 123.537 0.589 . . . . 0.0 113.55 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -88.17 110.26 20.55 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 121.352 0.596 . . . . 0.0 110.666 -178.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.4 tt -67.99 -18.94 24.22 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.798 -176.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 22.9 m -71.08 -50.55 32.54 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.456 0.703 . . . . 0.0 111.008 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.4 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 27.3 mm-40 -64.66 -38.64 91.69 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.903 174.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.23 -52.68 62.59 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 124.127 0.892 . . . . 0.0 112.527 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -65.06 -41.15 91.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 O-C-N 123.583 0.552 . . . . 0.0 110.888 178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.8 t -59.41 -42.7 92.4 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.612 0.57 . . . . 0.0 111.227 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 85.9 mt -71.18 -38.14 72.14 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.049 0.54 . . . . 0.0 111.559 -177.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.422 ' HB3' HD12 ' A' ' 34' ' ' ILE . 37.8 mt -76.78 -26.43 54.49 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 37.8 p -85.05 -40.65 16.58 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 118.163 0.438 . . . . 0.0 110.877 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.496 ' HA ' ' HG2' ' A' ' 62' ' ' ARG . 61.9 m-20 -77.62 19.69 0.36 Allowed 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 113.291 0.849 . . . . 0.0 113.291 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.32 -20.92 63.88 Favored 'General case' 0 CA--C 1.558 1.252 0 CA-C-O 120.986 0.422 . . . . 0.0 109.996 160.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.496 ' HG2' ' HA ' ' A' ' 60' ' ' ASP . 30.3 ptt180 -58.94 -36.19 74.37 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 125.186 1.394 . . . . 0.0 111.874 171.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.1 p -102.81 15.88 5.43 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.684 0.793 . . . . 0.0 110.881 -174.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.3 mmmt -62.28 105.82 0.66 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.444 0.697 . . . . 0.0 109.829 170.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -52.22 135.99 40.12 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 125.053 1.341 . . . . 0.0 112.513 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -82.82 113.98 3.11 Favored 'Cis proline' 0 C--N 1.381 2.246 0 C-N-CA 124.566 -1.014 . . . . 0.0 111.291 -1.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 56.4 p -100.25 -87.37 0.37 Allowed 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -178.83 164.71 1.55 Allowed 'General case' 0 C--O 1.246 0.916 0 C-N-CA 124.168 0.987 . . . . 0.0 110.147 -171.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -136.26 133.17 36.71 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 168.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.9 p -93.49 93.42 8.1 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.306 0.643 . . . . 0.0 111.121 -173.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.1 m -82.45 147.22 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.383 172.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.93 76.34 9.77 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.2 m -152.87 154.96 36.16 Favored 'General case' 0 C--O 1.243 0.733 0 C-N-CA 124.426 1.091 . . . . 0.0 109.123 -173.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -66.52 128.65 93.96 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 122.987 0.515 . . . . 0.0 109.674 171.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -69.95 151.79 68.1 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 122.66 2.24 . . . . 0.0 112.147 174.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 32.7 t -77.26 168.88 19.31 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.195 0.598 . . . . 0.0 110.148 175.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -69.52 87.83 0.48 Allowed 'General case' 0 C--N 1.349 0.576 0 C-N-CA 123.292 0.637 . . . . 0.0 110.991 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.1 p -113.19 107.41 22.9 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.03 0 C-N-CA 124.546 1.138 . . . . 0.0 109.398 175.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -103.27 139.11 39.15 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.884 0.874 . . . . 0.0 108.947 178.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.49 31.33 3.77 Favored Glycine 0 C--N 1.347 1.158 0 O-C-N 123.478 0.486 . . . . 0.0 112.942 -179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -66.49 90.23 0.16 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.606 0.763 . . . . 0.0 110.8 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.37 -2.06 43.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.199 1.0 . . . . 0.0 111.038 177.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.73 144.26 51.0 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.735 0.814 . . . . 0.0 111.229 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -90.66 37.44 0.92 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.676 0.791 . . . . 0.0 110.33 -178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -64.46 146.05 55.14 Favored 'General case' 0 C--O 1.243 0.742 0 C-N-CA 123.943 0.897 . . . . 0.0 110.234 176.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -61.98 104.07 0.42 Allowed 'General case' 0 C--O 1.245 0.862 0 O-C-N 123.833 0.708 . . . . 0.0 109.423 171.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 27.1 m -73.95 142.92 14.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.715 177.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.37 15.78 19.1 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.731 0.813 . . . . 0.0 109.761 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.07 165.25 9.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.396 1.078 . . . . 0.0 112.715 -179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.447 ' H ' ' HD3' ' A' ' 90' ' ' LYS . 0.1 OUTLIER -51.51 148.51 5.11 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 124.225 1.01 . . . . 0.0 111.822 175.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 24.3 m -121.85 23.87 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 CA-C-O 121.967 0.889 . . . . 0.0 110.009 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.553 HG13 ' H ' ' A' ' 129' ' ' ALA . 40.7 mm -105.95 80.15 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-N 114.203 -1.362 . . . . 0.0 109.114 -171.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -124.93 147.27 48.94 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.937 172.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -144.23 16.76 1.71 Allowed 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.531 0.733 . . . . 0.0 110.895 -173.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.3 p -78.22 -167.12 0.95 Allowed 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.919 0.39 . . . . 0.0 110.949 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -82.16 10.32 7.0 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -171.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -70.7 121.71 18.46 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 123.015 0.526 . . . . 0.0 110.571 175.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -85.73 165.92 16.55 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.372 0.669 . . . . 0.0 111.017 178.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.503 ' HE3' ' HB2' ' A' ' 101' ' ' ASP . 58.6 tttp -164.06 149.03 10.34 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.665 1.186 . . . . 0.0 107.993 -172.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -98.15 -20.67 17.16 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 122.485 0.314 . . . . 0.0 111.492 -175.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.503 ' HB2' ' HE3' ' A' ' 99' ' ' LYS . 4.7 m-20 -65.23 -47.09 78.03 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.17 0.588 . . . . 0.0 112.185 -173.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -32.15 72.44 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.437 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -66.15 -44.85 82.94 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 122.94 0.496 . . . . 0.0 110.393 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -62.56 -45.96 90.54 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 124.011 0.819 . . . . 0.0 110.677 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -57.76 11.33 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.206 1.003 . . . . 0.0 111.83 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.2 mm -64.47 -42.18 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.926 0.891 . . . . 0.0 111.188 -176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.78 88.65 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.342 0.657 . . . . 0.0 111.528 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.7 tt -66.01 -45.65 80.77 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 17.5 m -67.69 -27.78 67.12 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.614 0.765 . . . . 0.0 111.908 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.9 tt -81.14 -45.85 15.8 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.85 0.86 . . . . 0.0 109.889 -177.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.4 tt -88.6 -59.35 2.26 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.311 0.645 . . . . 0.0 109.319 -172.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -80.28 164.6 23.07 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.116 0.566 . . . . 0.0 109.74 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.0 m -80.37 118.69 73.61 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 123.22 0.608 . . . . 0.0 109.511 174.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.36 157.52 60.87 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.023 2.482 . . . . 0.0 110.972 173.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.532 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 11.0 mmpt? -84.07 80.87 9.03 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 121.552 0.692 . . . . 0.0 109.983 -178.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.434 HG12 ' HB2' ' A' ' 121' ' ' ARG . 22.4 mt -134.59 63.63 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -87.35 -45.26 10.73 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 121.297 0.57 . . . . 0.0 109.773 177.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -148.5 14.38 0.97 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.771 1.229 . . . . 0.0 108.937 175.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -80.39 -41.88 23.83 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 124.671 1.188 . . . . 0.0 110.364 -175.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 69.46 38.04 79.4 Favored Glycine 0 C--N 1.348 1.197 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.731 -177.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.434 ' HB2' HG12 ' A' ' 116' ' ' ILE . 78.8 mtp180 -86.55 7.33 26.63 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.474 0.71 . . . . 0.0 111.248 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -65.21 -36.06 83.02 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.939 0.896 . . . . 0.0 111.937 -178.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 4.8 tt -126.58 107.44 10.22 Favored 'General case' 0 C--O 1.241 0.608 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 174.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -127.25 101.88 6.68 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 176.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -67.71 119.6 12.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.361 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -67.41 108.86 2.95 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 171.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 34.9 p-80 -61.1 139.57 58.06 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.963 0.505 . . . . 0.0 110.863 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.09 146.72 45.57 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.554 0.693 . . . . 0.0 111.252 -176.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.553 ' H ' HG13 ' A' ' 92' ' ' ILE . . . -126.2 46.08 2.51 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.049 -1.463 . . . . 0.0 107.049 168.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 54.7 m -52.99 97.23 0.02 OUTLIER 'General case' 0 C--N 1.365 1.266 0 CA-C-N 113.989 -1.459 . . . . 0.0 112.101 -174.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 30.7 m -77.55 78.65 4.06 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 123.745 0.818 . . . . 0.0 109.707 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.293 0 C-N-CA 123.702 0.801 . . . . 0.0 108.989 178.775 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 . . . . . 0 N--CA 1.483 1.195 0 CA-C-O 119.316 -0.373 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.1 ttt -51.55 -51.99 50.82 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.826 0.851 . . . . 0.0 111.935 -175.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.592 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -52.48 -39.86 61.68 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.466 0.707 . . . . 0.0 112.605 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.592 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.1 mm? -62.55 -51.99 65.18 Favored 'General case' 0 C--N 1.364 1.212 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 176.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 55.5 m-20 -60.14 -46.28 90.18 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 124.553 1.158 . . . . 0.0 111.809 -174.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -62.26 -55.86 24.24 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 124.138 0.899 . . . . 0.0 110.596 -178.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.613 HD23 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -62.38 -49.44 75.54 Favored 'General case' 0 C--N 1.356 0.865 0 O-C-N 123.806 0.691 . . . . 0.0 111.019 -176.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.1 ttt-85 -57.27 -34.4 68.61 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.648 1.179 . . . . 0.0 111.493 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.76 -54.07 26.57 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.558 175.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.0 pt -88.5 -6.47 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -167.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 p -105.49 -40.11 5.9 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.306 0.643 . . . . 0.0 109.535 171.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.72 1.8 67.78 Favored Glycine 0 C--N 1.346 1.104 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.982 -176.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.573 HD12 HD13 ' A' ' 58' ' ' LEU . 67.1 mt -78.98 122.21 33.74 Favored 'Isoleucine or valine' 0 C--N 1.348 0.516 0 C-N-CA 123.939 0.896 . . . . 0.0 111.262 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -83.05 -21.0 33.92 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.985 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 10.5 m-20 -66.87 109.13 3.03 Favored Pre-proline 0 N--CA 1.479 0.979 0 C-N-CA 123.793 0.837 . . . . 0.0 110.061 -177.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -69.17 -29.54 26.51 Favored 'Trans proline' 0 C--N 1.373 1.85 0 C-N-CA 122.512 2.142 . . . . 0.0 111.763 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 33.8 m -61.4 -43.07 99.5 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.284 0.634 . . . . 0.0 109.909 175.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -60.73 -39.15 87.58 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 123.404 0.44 . . . . 0.0 110.36 178.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.613 ' HA ' HD23 ' A' ' 28' ' ' LEU . 62.0 mt -67.72 -52.85 32.82 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 124.19 0.931 . . . . 0.0 111.499 -175.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -62.36 -49.73 74.42 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 122.697 0.399 . . . . 0.0 111.54 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -65.33 -26.77 68.19 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.978 0.511 . . . . 0.0 111.878 -176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.23 -45.24 70.28 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 122.618 0.367 . . . . 0.0 110.502 171.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.468 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -66.31 -23.15 66.33 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.555 0.742 . . . . 0.0 111.091 175.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.2 mpmm? -75.62 -45.37 37.81 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.363 0.665 . . . . 0.0 109.425 173.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.65 -12.88 61.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.861 0.864 . . . . 0.0 112.048 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 98.5 p -110.44 -4.68 15.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.366 0.667 . . . . 0.0 111.725 178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 65.05 20.88 12.17 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.551 1.14 . . . . 0.0 112.08 -178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.88 2.57 32.08 Favored Glycine 0 C--N 1.348 1.221 0 CA-C-O 119.543 -0.587 . . . . 0.0 113.318 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -89.42 115.63 27.01 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.009 0.523 . . . . 0.0 110.305 -179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.556 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.6 tp -62.38 -39.13 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.468 0.307 . . . . 0.0 111.774 -173.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.1 m -66.05 -47.66 73.64 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.795 0.838 . . . . 0.0 110.89 -172.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.9 mm-40 -65.44 -36.79 84.98 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.239 0.615 . . . . 0.0 110.858 177.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.92 -44.75 87.06 Favored 'General case' 0 C--O 1.248 0.977 0 O-C-N 123.586 0.554 . . . . 0.0 111.336 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 51' ' ' ILE . 38.9 t -62.1 -49.3 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.866 177.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 m -54.55 -45.84 73.52 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.136 0.974 . . . . 0.0 111.762 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.2 mt -71.49 -34.19 69.92 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.124 -175.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.573 HD13 HD12 ' A' ' 34' ' ' ILE . 62.8 mt -72.77 -45.52 58.19 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 175.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.1 p -70.88 -12.31 61.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.481 0.713 . . . . 0.0 112.012 -178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.48 ' HA ' ' HB ' ' A' ' 63' ' ' VAL . 27.2 t70 -58.7 -18.83 34.55 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.712 0.805 . . . . 0.0 111.866 177.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -51.09 -35.56 35.66 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.41 1.084 . . . . 0.0 112.517 175.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -109.89 -19.61 13.05 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.081 0.953 . . . . 0.0 111.223 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.48 ' HB ' ' HA ' ' A' ' 60' ' ' ASP . 97.6 t -79.19 -28.94 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.069 0.547 . . . . 0.0 111.518 -176.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -64.64 101.65 0.49 Allowed 'General case' 0 CA--C 1.562 1.436 0 CA-C-O 122.098 0.951 . . . . 0.0 110.197 178.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.19 141.89 58.5 Favored Pre-proline 0 CA--C 1.563 1.459 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.407 -178.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -85.88 117.0 4.13 Favored 'Cis proline' 0 C--N 1.378 2.1 0 C-N-CA 124.451 -1.062 . . . . 0.0 111.831 -6.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -63.35 -50.01 71.62 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.554 0.741 . . . . 0.0 110.347 -178.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -116.52 169.56 9.24 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.402 177.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -67.21 -46.39 73.98 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.158 0.504 . . . . 0.0 110.098 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 40.3 p -87.92 114.3 24.4 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.792 175.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 33.8 m -77.89 -176.6 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 122.904 0.481 . . . . 0.0 109.994 174.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -83.48 38.06 0.6 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.362 0.665 . . . . 0.0 111.88 -177.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.5 m 56.19 26.47 10.35 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.825 1.25 . . . . 0.0 111.009 -177.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -84.64 151.38 58.4 Favored Pre-proline 0 CA--C 1.545 0.781 0 CA-C-N 114.158 -1.383 . . . . 0.0 110.739 -170.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.6 157.65 48.37 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 122.23 1.954 . . . . 0.0 111.292 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.3 m -127.67 82.12 2.07 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.419 0.688 . . . . 0.0 110.42 -175.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -108.84 66.34 0.63 Allowed 'General case' 0 C--O 1.241 0.641 0 CA-C-O 122.495 1.14 . . . . 0.0 108.954 173.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 45.0 t -77.07 130.8 35.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.198 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -60.31 110.21 1.18 Allowed 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.783 0.677 . . . . 0.0 110.647 175.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 164.62 51.55 0.02 OUTLIER Glycine 0 C--N 1.336 0.573 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.896 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 56.3 m -62.31 94.71 0.06 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.164 0.586 . . . . 0.0 110.424 175.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.64 -33.55 69.0 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.926 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -77.59 147.1 35.83 Favored 'General case' 0 C--O 1.243 0.763 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.351 173.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -64.15 115.31 4.86 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 175.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -158.28 86.82 0.89 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.325 0.583 . . . . 0.0 110.165 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -103.91 -177.75 3.46 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.613 173.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 m -75.21 177.85 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 123.41 0.684 . . . . 0.0 110.485 172.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.9 mp -81.77 59.28 4.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 110.349 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -97.5 112.62 24.39 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 123.65 0.78 . . . . 0.0 110.094 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -158.53 153.25 24.75 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 178.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.2 t -108.72 26.31 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-O 122.623 1.202 . . . . 0.0 109.119 177.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 42.8 mm -109.27 75.45 0.39 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 107.327 -1.36 . . . . 0.0 107.327 179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -158.51 22.04 0.23 Allowed 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.894 -1.503 . . . . 0.0 109.956 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.4 pp -86.85 63.85 8.18 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 122.305 1.05 . . . . 0.0 109.235 177.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.4 p -71.25 150.47 45.2 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 114.275 -1.33 . . . . 0.0 110.816 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 71.49 9.68 6.45 Favored 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 124.891 1.276 . . . . 0.0 111.163 -178.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -82.77 126.85 32.86 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.748 0.819 . . . . 0.0 109.717 175.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -158.57 153.13 24.47 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.952 0.901 . . . . 0.0 109.262 178.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.611 ' HD2' ' HB3' ' A' ' 101' ' ' ASP . 2.7 ttmp? -96.94 160.04 14.57 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -98.08 14.28 28.06 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.287 0.635 . . . . 0.0 111.455 -178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.611 ' HB3' ' HD2' ' A' ' 99' ' ' LYS . 8.0 p-10 -70.51 -43.93 68.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.996 0.518 . . . . 0.0 112.015 -170.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.404 ' H ' HD13 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -72.9 -26.87 61.57 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.757 -178.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.9 mp0 -64.68 -44.59 89.86 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.496 0.318 . . . . 0.0 110.323 170.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.39 -44.39 91.45 Favored 'General case' 0 N--CA 1.476 0.85 0 O-C-N 123.665 0.603 . . . . 0.0 111.211 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.63 -48.22 75.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.761 0.824 . . . . 0.0 111.965 -177.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 43.9 mm -68.39 -38.97 80.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.86 0.464 . . . . 0.0 110.764 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.64 -41.27 97.27 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.962 0.505 . . . . 0.0 111.187 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 8.6 tt -63.82 -45.8 87.97 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.605 176.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.7 t -66.37 -26.9 67.48 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.044 0.937 . . . . 0.0 111.798 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -80.58 -44.91 18.2 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.299 0.64 . . . . 0.0 109.799 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 10.8 mp -80.15 -62.98 1.51 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.857 0.463 . . . . 0.0 110.308 -176.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -101.11 177.38 4.96 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.9 p -136.43 148.85 65.7 Favored Pre-proline 0 CA--C 1.543 0.692 0 C-N-CA 123.59 0.756 . . . . 0.0 109.052 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -56.9 126.97 23.95 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.981 2.454 . . . . 0.0 112.609 -176.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -68.49 -15.93 63.71 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.611 0.765 . . . . 0.0 111.233 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.42 ' HA ' ' HA ' ' A' ' 122' ' ' ASP . 58.7 mt -61.48 106.02 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 123.087 0.555 . . . . 0.0 109.54 171.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.87 -20.28 42.63 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.696 0.799 . . . . 0.0 111.649 179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -105.53 -163.76 0.97 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.846 0.858 . . . . 0.0 110.905 -178.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -65.97 -35.12 79.72 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.209 0.604 . . . . 0.0 110.817 177.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -161.38 16.67 0.17 Allowed Glycine 0 C--N 1.346 1.084 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.942 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -112.17 118.04 34.25 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 178.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 5.1 p-10 -91.26 16.81 9.25 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.637 0.775 . . . . 0.0 110.651 168.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 6.5 mp -73.26 77.17 1.32 Allowed 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.178 0.991 . . . . 0.0 109.662 178.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -84.89 99.14 10.74 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 114.781 -1.099 . . . . 0.0 108.729 -178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 28.3 mmm180 -84.01 93.73 8.14 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.691 -177.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -131.97 -59.8 0.93 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.812 0.845 . . . . 0.0 108.896 -179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 44.0 t60 -124.97 106.91 10.32 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 174.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -131.67 168.49 17.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.282 1.033 . . . . 0.0 108.901 177.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.72 93.82 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.308 0.643 . . . . 0.0 110.237 170.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 33.4 p -71.9 96.26 1.66 Allowed 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.238 -176.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 47.0 t -58.85 122.31 13.3 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.246 1.018 . . . . 0.0 111.454 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 0.983 0 C-N-CA 123.571 0.749 . . . . 0.0 110.432 179.98 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.6 tp60 . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 111.366 0.135 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -57.23 -34.44 68.57 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.694 0.797 . . . . 0.0 112.109 -174.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.556 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.1 pt? -59.15 -41.71 88.97 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 123.2 0.6 . . . . 0.0 112.178 177.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.556 HD22 ' HG ' ' A' ' 24' ' ' LEU . 2.7 mm? -72.78 -44.91 60.98 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 122.104 0.161 . . . . 0.0 110.657 177.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 67.6 m-20 -59.27 -51.12 71.31 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 124.071 0.857 . . . . 0.0 111.124 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.3 mt-30 -66.37 -46.98 74.85 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.11 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.489 HD22 ' CD2' ' A' ' 44' ' ' LEU . 19.0 tp -56.19 -49.99 72.5 Favored 'General case' 0 C--N 1.368 1.382 0 O-C-N 123.647 0.592 . . . . 0.0 110.428 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.455 ' NH2' HE22 ' A' ' 35' ' ' GLN . 66.1 ttt180 -54.43 -40.44 68.33 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.797 1.239 . . . . 0.0 111.546 177.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -66.89 -46.74 73.98 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.917 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.9 pt -93.38 1.59 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -170.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.513 HG21 HD12 ' A' ' 58' ' ' LEU . 68.6 p -117.83 -41.11 2.94 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.089 0.556 . . . . 0.0 110.363 171.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.85 2.47 55.12 Favored Glycine 0 N--CA 1.469 0.89 0 CA-C-N 115.645 -0.707 . . . . 0.0 113.006 -179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.674 HD12 HD13 ' A' ' 58' ' ' LEU . 67.6 mt -82.15 115.55 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 110.937 -173.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.455 HE22 ' NH2' ' A' ' 29' ' ' ARG . 16.6 mm100 -79.65 -20.52 46.52 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.665 1.186 . . . . 0.0 111.793 179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.99 108.02 3.26 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 123.517 0.727 . . . . 0.0 109.823 176.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.0 -27.2 50.45 Favored 'Trans proline' 0 C--N 1.385 2.46 0 C-N-CA 122.603 2.202 . . . . 0.0 111.137 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 18.7 m -58.05 -51.23 70.54 Favored 'General case' 0 C--N 1.352 0.717 0 C-N-CA 124.12 0.968 . . . . 0.0 111.19 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.51 ' CD2' HD13 ' A' ' 34' ' ' ILE . 0.4 OUTLIER -62.49 -28.9 70.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.112 0.965 . . . . 0.0 110.664 -179.058 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.1 mt -73.2 -54.82 7.49 Favored 'General case' 0 CA--C 1.55 0.978 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.623 179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -57.55 -38.09 74.17 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.397 0.679 . . . . 0.0 111.55 176.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -69.03 -37.04 78.38 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.535 0.734 . . . . 0.0 111.829 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.436 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -62.5 -47.77 82.49 Favored 'General case' 0 C--O 1.241 0.608 0 O-C-N 123.366 0.416 . . . . 0.0 110.868 172.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.52 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.1 mm? -64.67 -35.6 81.56 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.563 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 53.0 pttt -75.43 -36.53 60.77 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.89 -33.82 74.4 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.463 0.705 . . . . 0.0 110.616 178.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 m -91.1 3.14 55.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.295 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 65.55 12.05 7.91 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.141 1.377 . . . . 0.0 113.099 173.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.4 -11.56 7.16 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-O 119.518 -0.601 . . . . 0.0 112.624 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -79.64 108.24 13.02 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 117.401 0.601 . . . . 0.0 109.999 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.491 ' O ' HG23 ' A' ' 55' ' ' VAL . 16.2 tt -67.85 -31.34 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.129 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.969 -175.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 23.9 m -70.97 -43.39 68.18 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.039 0.536 . . . . 0.0 110.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.449 HE21 ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -68.04 -32.05 72.14 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.207 175.32 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.67 -43.96 93.78 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.386 0.675 . . . . 0.0 110.978 174.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.0 t -60.81 -46.4 96.25 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 O-C-N 123.69 0.619 . . . . 0.0 109.698 174.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 17.6 m -55.82 -39.18 71.02 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.567 0.747 . . . . 0.0 112.158 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.75 -40.28 63.61 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.326 0.651 . . . . 0.0 111.741 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.674 HD13 HD12 ' A' ' 34' ' ' ILE . 88.6 mt -68.69 -46.29 69.4 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 122.528 0.331 . . . . 0.0 111.878 179.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.6 p -63.84 -25.52 68.21 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 124.096 0.873 . . . . 0.0 111.198 -178.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.71 -64.65 0.81 Allowed 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.34 171.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 64' ' ' LYS . 37.7 mt-10 -65.8 -25.38 67.21 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -168.047 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.09 -8.53 57.63 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 122.98 0.512 . . . . 0.0 112.008 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.7 18.16 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.563 1.469 0 C-N-CA 123.386 0.675 . . . . 0.0 109.743 178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.417 ' HB2' ' HA ' ' A' ' 61' ' ' GLU . 47.8 tttp -77.64 93.89 4.3 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.243 0.617 . . . . 0.0 110.973 -173.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -96.51 152.78 38.84 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.515 0.726 . . . . 0.0 110.254 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -76.48 118.27 5.49 Favored 'Cis proline' 0 C--N 1.385 2.449 0 CA-C-N 120.417 1.185 . . . . 0.0 113.885 3.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.7 t -130.21 110.36 11.51 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.782 1.233 . . . . 0.0 107.881 173.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -105.58 27.67 8.18 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 122.308 1.052 . . . . 0.0 109.047 177.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -84.38 58.17 4.69 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.408 1.083 . . . . 0.0 109.042 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.0 t -80.15 139.5 36.78 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.848 -174.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.0 t -98.42 102.32 13.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 177.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.29 -24.19 34.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.387 0.675 . . . . 0.0 111.539 -179.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 t -77.53 156.34 31.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.006 0.523 . . . . 0.0 110.83 178.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.62 143.12 31.54 Favored Pre-proline 0 CA--C 1.554 1.11 0 C-N-CA 124.063 0.945 . . . . 0.0 110.624 -177.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -58.76 117.23 3.91 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 123.324 2.683 . . . . 0.0 111.668 168.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.8 p -105.37 6.51 32.68 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.694 0.797 . . . . 0.0 111.256 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -75.49 82.83 2.55 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.249 1.02 . . . . 0.0 110.153 -171.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.4 m -110.98 154.15 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 124.498 1.119 . . . . 0.0 109.339 176.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -75.38 -49.35 19.29 Favored 'General case' 0 C--O 1.243 0.713 0 C-N-CA 123.15 0.58 . . . . 0.0 110.375 179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 132.1 -36.47 2.2 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.412 -176.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 24.9 m -104.04 173.79 6.15 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.473 0.709 . . . . 0.0 110.862 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.24 63.72 7.32 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.444 1.097 . . . . 0.0 109.675 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -99.86 -145.48 0.33 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 124.294 1.038 . . . . 0.0 109.833 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -73.86 70.02 1.42 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 122.436 1.112 . . . . 0.0 110.844 174.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -100.3 137.92 38.07 Favored 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.88 1.272 . . . . 0.0 108.457 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -64.25 108.96 1.72 Allowed 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 169.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 28.0 m -64.57 142.51 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 123.493 0.717 . . . . 0.0 112.304 -169.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.8 tt -97.16 81.26 3.02 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.67 158.82 43.56 Favored 'General case' 0 C--O 1.246 0.901 0 CA-C-N 114.931 -1.031 . . . . 0.0 108.658 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.422 ' HE3' ' N ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -64.18 147.93 51.18 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-O 121.422 0.63 . . . . 0.0 110.495 176.481 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 16.1 m -123.99 38.38 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.481 1.112 . . . . 0.0 108.419 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 42.8 mm 61.18 83.81 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.357 0.912 0 C-N-CA 125.18 1.392 . . . . 0.0 109.123 -168.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -139.91 139.85 36.29 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 114.602 -1.181 . . . . 0.0 108.632 -177.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.31 -29.7 2.96 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.607 0.763 . . . . 0.0 109.651 178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.9 t -60.62 133.2 55.86 Favored 'General case' 0 C--N 1.354 0.776 0 CA-C-O 121.716 0.769 . . . . 0.0 111.707 -170.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -100.82 12.08 38.28 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.047 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -63.55 -29.94 71.13 Favored 'General case' 0 C--N 1.362 1.121 0 C-N-CA 124.044 0.938 . . . . 0.0 110.705 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -55.71 147.21 19.12 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.574 0.75 . . . . 0.0 110.138 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.656 ' HD3' ' HB2' ' A' ' 101' ' ' ASP . 0.1 OUTLIER -64.42 151.88 42.99 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 121.033 0.444 . . . . 0.0 109.919 172.72 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -91.27 -9.25 45.8 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.527 0.731 . . . . 0.0 110.291 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.656 ' HB2' ' HD3' ' A' ' 99' ' ' LYS . 7.5 m-20 -59.43 -47.86 83.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.648 0.779 . . . . 0.0 112.259 -173.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.583 HD12 ' HG3' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -68.54 -33.18 73.65 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 123.231 0.332 . . . . 0.0 110.337 179.097 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.401 ' H ' HD13 ' A' ' 102' ' ' LEU . 25.9 mm-40 -72.16 -29.54 64.13 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.642 0.777 . . . . 0.0 111.284 177.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.15 -44.83 59.45 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.799 0.84 . . . . 0.0 109.474 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.89 73.19 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.609 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.8 mm -71.04 -40.35 75.83 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.457 0.703 . . . . 0.0 111.193 -177.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.478 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -60.7 -42.01 96.35 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 123.387 0.429 . . . . 0.0 110.617 176.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.36 -50.48 67.54 Favored 'General case' 0 C--N 1.353 0.745 0 O-C-N 123.815 0.697 . . . . 0.0 109.71 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -63.8 -29.85 71.0 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.556 0.742 . . . . 0.0 111.211 -178.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.9 tp -70.42 -42.61 71.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.934 0.894 . . . . 0.0 110.561 177.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 74.7 mt -74.17 -26.82 60.51 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.122 177.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -93.05 1.63 57.16 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.502 0.721 . . . . 0.0 110.918 -178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.2 m -57.77 142.19 78.79 Favored Pre-proline 0 C--N 1.359 0.992 0 C-N-CA 123.081 0.552 . . . . 0.0 110.509 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -61.45 151.08 82.09 Favored 'Trans proline' 0 C--N 1.38 2.2 0 C-N-CA 122.79 2.326 . . . . 0.0 112.288 -173.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -5.69 5.47 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.07 0.948 . . . . 0.0 112.606 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 22.5 mt -59.71 -23.19 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 C-N-CA 124.879 1.272 . . . . 0.0 111.834 176.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -60.31 -27.74 67.56 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.335 1.054 . . . . 0.0 111.846 175.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -121.86 -72.2 0.7 Allowed 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.755 0.822 . . . . 0.0 110.166 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -132.73 79.94 1.87 Allowed 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.904 0.882 . . . . 0.0 110.616 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -156.82 8.49 0.24 Allowed Glycine 0 CA--C 1.535 1.287 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.631 171.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -51.66 97.05 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.036 1.334 . . . . 0.0 111.249 172.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -79.69 -50.12 11.09 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.772 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 5.2 mp -83.19 83.74 7.74 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.236 0.614 . . . . 0.0 109.864 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -86.56 -40.29 15.36 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 172.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.71 132.62 56.36 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 163.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . 0.447 ' N ' ' SD ' ' A' ' 126' ' ' MET . 2.8 mpp? -97.75 -67.4 0.85 Allowed 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -177.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 59.1 m80 -147.82 138.43 23.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.387 1.075 . . . . 0.0 109.572 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.79 110.2 11.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 173.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -72.64 -67.16 0.58 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.517 0.727 . . . . 0.0 111.227 -175.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 1.4 p -159.17 107.76 1.85 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.188 1.395 . . . . 0.0 108.147 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.2 t -67.4 -20.46 65.54 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.361 0.665 . . . . 0.0 112.269 -176.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.248 0 C-N-CA 123.577 0.751 . . . . 0.0 109.169 176.349 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.403 HE21 ' HA ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.377 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.5 ttt -49.02 -46.81 44.64 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.912 0.885 . . . . 0.0 113.359 -168.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.453 HD23 ' H ' ' A' ' 24' ' ' LEU . 1.8 pt? -51.83 -44.95 63.78 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.685 0.794 . . . . 0.0 111.85 175.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -68.43 -38.63 81.37 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.019 177.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -64.37 -53.72 44.25 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 123.634 0.584 . . . . 0.0 110.376 -178.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -50.04 -56.46 10.67 Favored 'General case' 0 C--N 1.361 1.077 0 O-C-N 124.516 1.135 . . . . 0.0 109.884 178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.4 tp -57.7 -50.16 74.12 Favored 'General case' 0 C--N 1.358 0.97 0 O-C-N 124.799 1.312 . . . . 0.0 111.166 -178.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -57.26 -39.24 75.2 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.655 1.182 . . . . 0.0 112.489 -175.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -77.43 -37.02 52.57 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.303 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.1 pt -90.11 -14.11 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 80.2 p -102.96 -31.18 10.36 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.288 0.635 . . . . 0.0 110.409 173.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 93.11 -7.43 76.17 Favored Glycine 0 N--CA 1.47 0.917 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.963 -178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.514 HD12 HD13 ' A' ' 58' ' ' LEU . 84.6 mt -80.04 117.35 25.72 Favored 'Isoleucine or valine' 0 C--N 1.349 0.562 0 C-N-CA 124.004 0.921 . . . . 0.0 110.993 -173.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -82.35 -25.82 33.5 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.749 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 6.7 m-20 -58.92 109.35 1.81 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 124.081 0.952 . . . . 0.0 111.13 -178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -66.84 -23.13 48.22 Favored 'Trans proline' 0 C--N 1.38 2.197 0 C-N-CA 123.113 2.542 . . . . 0.0 111.977 -177.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.2 m -56.91 -52.13 66.39 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.971 0.908 . . . . 0.0 109.933 174.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -63.35 -38.51 91.45 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.784 0.834 . . . . 0.0 110.897 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.594 ' HA ' HD23 ' A' ' 28' ' ' LEU . 73.8 mt -69.63 -55.49 9.9 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 124.261 0.976 . . . . 0.0 111.437 -173.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -63.96 -42.41 97.29 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.252 0.621 . . . . 0.0 111.769 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 45.2 mt-10 -72.52 -29.41 63.57 Favored 'General case' 0 C--N 1.351 0.647 0 C-N-CA 122.876 0.47 . . . . 0.0 111.881 -176.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.15 74.7 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 117.838 0.29 . . . . 0.0 110.407 172.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.463 ' CD2' HD22 ' A' ' 28' ' ' LEU . 3.0 mm? -67.79 -32.72 73.48 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.794 0.838 . . . . 0.0 110.891 178.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 3.2 tmmm? -71.53 -44.9 63.77 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.921 0.888 . . . . 0.0 110.238 178.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.57 -30.47 67.18 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.729 0.812 . . . . 0.0 111.447 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.3 p -85.68 0.48 52.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.448 0.699 . . . . 0.0 112.135 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 64.5 25.75 13.3 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 122.08 0.943 . . . . 0.0 110.491 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 96.3 -5.1 65.12 Favored Glycine 0 C--N 1.348 1.212 0 CA-C-N 115.575 -0.739 . . . . 0.0 113.456 177.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -74.58 108.51 7.38 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.552 ' O ' HG23 ' A' ' 55' ' ' VAL . 7.0 tp -55.73 -44.68 78.05 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 O-C-N 123.478 0.486 . . . . 0.0 111.784 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.5 m -66.28 -39.37 89.35 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.842 0.857 . . . . 0.0 111.329 -174.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.492 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 mm-40 -62.9 -43.32 99.12 Favored 'General case' 0 C--N 1.354 0.792 0 C-N-CA 122.976 0.51 . . . . 0.0 110.029 173.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -60.57 -41.08 93.88 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 124.082 0.864 . . . . 0.0 111.614 -179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -58.86 -49.86 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.318 -0.856 . . . . 0.0 109.299 173.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 42.1 t -61.75 -31.29 71.46 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.077 0.861 . . . . 0.0 111.788 -178.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.8 mt -73.24 -33.93 65.59 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.662 0.785 . . . . 0.0 110.975 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.514 HD13 HD12 ' A' ' 34' ' ' ILE . 80.2 mt -89.3 -17.54 28.75 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 179.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 41.4 p -96.91 -14.91 21.46 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.046 0.384 . . . . 0.0 111.867 -178.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -76.87 -20.38 56.35 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 171.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -62.49 -47.26 84.73 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 124.588 1.155 . . . . 0.0 111.666 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.7 ppt_? -72.08 -14.81 61.95 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.143 0.577 . . . . 0.0 112.383 -174.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 p -116.04 3.31 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.848 0.859 . . . . 0.0 109.961 -178.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -72.08 97.8 1.98 Allowed 'General case' 0 C--N 1.348 0.533 0 C-N-CA 123.515 0.726 . . . . 0.0 110.118 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.08 138.19 73.04 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.95 0.9 . . . . 0.0 112.611 -175.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -83.71 115.26 3.52 Favored 'Cis proline' 0 C--N 1.378 2.086 0 C-N-CA 124.311 -1.121 . . . . 0.0 112.931 -3.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 67.8 m -100.14 57.63 0.97 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 173.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -73.73 103.15 4.19 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -75.82 74.31 2.76 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.379 1.072 . . . . 0.0 110.118 -174.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 42.5 p -86.08 109.12 18.61 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.861 0.864 . . . . 0.0 109.95 -176.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 5.9 p -130.7 96.03 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-O 122.151 0.977 . . . . 0.0 110.908 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -92.71 -4.37 53.29 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.984 167.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 86.8 m -71.3 114.04 8.96 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -72.74 130.68 85.1 Favored Pre-proline 0 CA--C 1.557 1.224 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 170.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -62.99 110.5 1.16 Allowed 'Trans proline' 0 C--N 1.378 2.125 0 C-N-CA 122.956 2.437 . . . . 0.0 111.772 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 27.9 p -72.68 77.6 1.1 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.154 0.982 . . . . 0.0 110.859 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -88.21 -41.22 13.1 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.491 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 44.1 t 74.45 -20.54 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 C-N-CA 125.508 1.523 . . . . 0.0 112.366 178.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.69 101.11 0.76 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.117 0.967 . . . . 0.0 111.318 -172.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -82.45 -59.78 2.2 Favored Glycine 0 C--N 1.345 1.035 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 174.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 46.9 m 54.1 36.03 23.74 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.826 1.25 . . . . 0.0 111.806 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.3 55.92 3.45 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.598 0.759 . . . . 0.0 109.624 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -83.71 83.66 7.83 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.28 -176.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -97.78 -13.34 21.42 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.424 175.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -66.8 104.75 1.4 Allowed 'General case' 0 C--N 1.357 0.904 0 C-N-CA 123.175 0.59 . . . . 0.0 109.725 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -149.63 157.62 43.41 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 123.557 0.743 . . . . 0.0 109.365 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 30.9 m -83.51 122.03 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 172.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.5 mt -88.25 63.62 7.26 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 122.053 0.93 . . . . 0.0 108.713 179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -113.47 -174.18 2.41 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 114.402 -1.272 . . . . 0.0 109.432 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -142.17 141.15 32.58 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.5 p -107.12 18.34 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.867 0 CA-C-O 122.434 1.112 . . . . 0.0 110.008 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 29.6 mm -98.94 8.45 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.282 -179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -85.78 57.66 4.6 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.935 0.894 . . . . 0.0 110.756 -179.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -60.42 -28.31 68.16 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.572 1.149 . . . . 0.0 112.164 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.1 p -64.71 -24.39 67.55 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.404 1.082 . . . . 0.0 113.187 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -143.55 30.41 1.36 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.039 0.535 . . . . 0.0 110.457 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.1 -47.33 77.59 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.878 0.471 . . . . 0.0 110.542 177.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.35 165.62 12.03 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.971 0.909 . . . . 0.0 109.856 173.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -138.52 154.27 48.77 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.881 0.872 . . . . 0.0 108.793 174.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -86.31 16.95 4.0 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.685 0.794 . . . . 0.0 112.251 -178.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -67.45 -66.48 0.55 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.533 0.733 . . . . 0.0 110.832 -179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.435 ' O ' HG12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -59.9 -30.8 69.27 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.181 176.836 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -67.85 -45.17 75.35 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.135 0.974 . . . . 0.0 110.852 -176.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -73.45 -27.02 61.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.564 0.746 . . . . 0.0 110.903 178.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.87 -44.03 81.98 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.434 0.694 . . . . 0.0 111.233 174.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.435 HG12 ' O ' ' A' ' 102' ' ' LEU . 42.5 mm -64.53 -42.06 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.953 0.901 . . . . 0.0 109.793 175.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.74 91.92 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.935 0.894 . . . . 0.0 111.383 178.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 6.0 tt -66.08 -44.56 84.11 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.7 0.8 . . . . 0.0 109.378 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.8 t -66.49 -36.44 82.74 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.516 0.726 . . . . 0.0 112.193 -175.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 48.9 mt -97.44 -26.18 14.94 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -171.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 64.4 tp -88.67 -31.34 18.56 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.034 0.534 . . . . 0.0 110.497 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 74.41 163.77 0.27 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 127.324 2.249 . . . . 0.0 111.334 -170.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.1 m -94.98 119.0 66.55 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 123.4 0.68 . . . . 0.0 109.546 175.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -66.05 112.11 2.18 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.124 1.883 . . . . 0.0 110.112 172.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.583 ' HD3' ' H ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -86.97 50.94 2.11 Favored 'General case' 0 N--CA 1.488 1.466 0 CA-C-O 122.089 0.947 . . . . 0.0 111.312 -171.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.476 HG23 ' HA3' ' A' ' 120' ' ' GLY . 47.4 mt -88.45 73.54 0.99 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 174.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -82.49 -49.48 9.88 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 113.804 -1.544 . . . . 0.0 109.545 -171.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -140.81 106.17 5.05 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 114.631 -1.168 . . . . 0.0 107.98 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.409 ' HA ' ' HB2' ' A' ' 123' ' ' LEU . 30.8 t70 75.24 -61.04 0.49 Allowed 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 125.256 1.422 . . . . 0.0 112.068 -174.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . 0.476 ' HA3' HG23 ' A' ' 116' ' ' ILE . . . 55.21 -98.98 0.06 OUTLIER Glycine 0 C--N 1.355 1.616 0 O-C-N 123.68 0.612 . . . . 0.0 113.582 -175.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.64 23.17 0.28 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.669 0.788 . . . . 0.0 110.411 177.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -146.46 16.91 1.32 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-O 121.104 0.478 . . . . 0.0 111.586 -171.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 119' ' ' ASP . 0.2 OUTLIER -81.15 -6.25 58.62 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.912 0.485 . . . . 0.0 110.662 175.166 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -60.78 155.39 19.47 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.233 0.613 . . . . 0.0 109.915 169.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 82.07 6.23 1.07 Allowed 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 125.705 1.602 . . . . 0.0 110.872 -178.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 25.8 ttt -82.73 109.91 17.31 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 175.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -100.58 139.62 36.01 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.119 0.567 . . . . 0.0 110.236 179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -60.71 -48.12 83.21 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 51.78 73.7 0.3 Allowed 'General case' 0 C--N 1.351 0.668 0 O-C-N 125.092 1.495 . . . . 0.0 112.038 170.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 45.3 p -72.38 123.22 22.61 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.53 -178.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 44.6 m -73.91 -49.67 23.72 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.704 0.801 . . . . 0.0 110.008 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.256 1.403 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 178.722 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -61.52 -48.21 82.08 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.431 0.292 . . . . 0.0 111.081 -175.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.614 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -61.54 -40.93 96.44 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 124.345 1.058 . . . . 0.0 112.134 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.614 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -64.5 -51.38 63.25 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.929 0.892 . . . . 0.0 110.799 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -69.34 -44.09 72.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.294 1.038 . . . . 0.0 111.456 -172.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -64.64 -46.79 81.03 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 123.755 0.66 . . . . 0.0 110.949 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.489 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -61.39 -46.04 91.85 Favored 'General case' 0 C--N 1.363 1.188 0 O-C-N 123.552 0.533 . . . . 0.0 110.532 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -58.34 -36.95 74.19 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.782 0.833 . . . . 0.0 111.634 179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.86 -45.54 64.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.015 0.526 . . . . 0.0 111.052 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 18.3 pt -83.22 -19.84 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -172.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.499 HG21 HD12 ' A' ' 58' ' ' LEU . 81.4 p -98.91 -40.73 7.94 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.267 0.627 . . . . 0.0 110.142 176.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.49 -3.23 57.74 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.131 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.713 HD12 HD13 ' A' ' 58' ' ' LEU . 61.6 mt -77.74 113.99 17.66 Favored 'Isoleucine or valine' 0 C--N 1.355 0.822 0 C-N-CA 123.588 0.755 . . . . 0.0 111.012 -172.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -81.26 -15.72 54.73 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.706 -178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -77.25 114.13 37.43 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 176.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.434 ' HG2' HD23 ' A' ' 94' ' ' LEU . 74.4 Cg_endo -71.91 -15.86 29.45 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.776 2.317 . . . . 0.0 113.221 -176.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 23.2 t -67.17 -51.02 58.81 Favored 'General case' 0 C--N 1.353 0.752 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -55.63 -34.74 65.18 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 124.031 0.832 . . . . 0.0 111.881 176.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.489 ' HA ' HD23 ' A' ' 28' ' ' LEU . 54.2 mt -68.35 -53.81 21.53 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 123.911 0.757 . . . . 0.0 110.428 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -58.8 -38.26 78.19 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.757 175.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.46 ' HG2' HD13 ' A' ' 92' ' ' ILE . 41.8 mt-10 -74.97 -29.29 60.87 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.027 0.531 . . . . 0.0 111.806 -176.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.3 77.43 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.489 ' HG ' HD12 ' A' ' 24' ' ' LEU . 4.3 mm? -76.42 -23.32 53.98 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.929 0.892 . . . . 0.0 110.073 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -70.45 -56.36 6.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.899 1.28 . . . . 0.0 110.44 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.31 -29.71 69.36 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.974 0.91 . . . . 0.0 111.061 -176.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.506 ' HB2' ' HB2' ' A' ' 53' ' ' GLN . 89.4 p -84.43 -5.75 59.31 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.516 0.726 . . . . 0.0 112.052 177.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 70.1 13.32 7.79 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.1 1.36 . . . . 0.0 112.025 178.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.08 42.84 1.59 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 -179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -132.4 115.52 15.68 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.501 0.72 . . . . 0.0 109.352 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.3 tt -74.13 -21.1 17.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.327 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -171.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 83.7 m -73.06 -49.81 26.51 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.221 0.608 . . . . 0.0 110.435 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 47' ' ' SER . 29.0 mm-40 -60.19 -40.38 89.82 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.785 172.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.82 -52.99 63.38 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 124.238 0.961 . . . . 0.0 112.263 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.452 HG23 HG22 ' A' ' 32' ' ' THR . 10.1 p -64.48 -36.0 76.04 Favored 'Isoleucine or valine' 0 C--N 1.359 1.016 0 C-N-CA 122.6 0.36 . . . . 0.0 110.446 179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.7 t -63.03 -40.97 99.32 Favored 'General case' 0 CA--C 1.554 1.135 0 O-C-N 123.751 0.657 . . . . 0.0 111.27 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.56 -22.58 54.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.668 0.787 . . . . 0.0 111.648 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 HD12 ' A' ' 34' ' ' ILE . 82.5 mt -85.66 -29.21 24.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.529 0.331 . . . . 0.0 111.545 173.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.0 p -83.88 11.58 7.44 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 122.5 0.32 . . . . 0.0 111.019 174.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 64' ' ' LYS . 16.4 t70 -50.49 -41.3 53.09 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 123.815 0.846 . . . . 0.0 110.335 166.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -49.32 -34.87 16.75 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 124.758 1.223 . . . . 0.0 113.503 -177.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -99.15 -29.33 12.92 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.5 p -99.92 -0.25 10.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 122.852 0.461 . . . . 0.0 111.557 -172.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 60' ' ' ASP . 24.9 tttp -73.79 91.25 1.92 Allowed 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.098 0.559 . . . . 0.0 109.685 -178.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -61.17 144.7 90.97 Favored Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 123.798 0.839 . . . . 0.0 112.003 -176.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -81.61 106.26 0.86 Allowed 'Cis proline' 0 C--N 1.382 2.313 0 CA-C-N 119.546 0.873 . . . . 0.0 112.767 0.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 67.9 m -137.93 100.92 4.3 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 172.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -79.75 92.38 5.42 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 123.341 0.657 . . . . 0.0 110.104 -171.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -150.22 130.87 14.01 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.051 0.94 . . . . 0.0 108.697 176.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 45.9 p -76.79 82.3 3.38 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 121.577 0.703 . . . . 0.0 109.429 174.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.6 m -68.85 137.22 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.516 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -82.06 69.98 8.88 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.748 0.785 . . . . 0.0 109.706 177.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 88.6 m -158.57 120.96 3.64 Favored 'General case' 0 C--O 1.241 0.636 0 C-N-CA 125.656 1.582 . . . . 0.0 107.449 178.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -75.98 150.35 83.42 Favored Pre-proline 0 CA--C 1.551 0.995 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 176.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.37 103.89 0.07 OUTLIER 'Trans proline' 0 C--N 1.376 2.0 0 C-N-CA 123.224 2.616 . . . . 0.0 111.279 168.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 p -67.72 163.98 20.4 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.011 0.925 . . . . 0.0 111.358 -177.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -116.32 -18.92 10.37 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.201 0.6 . . . . 0.0 112.405 -167.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 10.6 t -105.71 48.66 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 CA-C-O 121.864 0.84 . . . . 0.0 111.089 -165.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -87.35 70.96 10.01 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.758 0.79 . . . . 0.0 109.66 175.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.05 -8.55 60.23 Favored Glycine 0 C--N 1.342 0.87 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.878 165.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 34.7 m -81.26 79.75 7.83 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.637 1.175 . . . . 0.0 109.925 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -76.3 -52.46 9.92 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.073 178.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . 63.13 30.78 16.04 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.598 1.159 . . . . 0.0 111.38 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -73.09 88.45 1.43 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.539 0.736 . . . . 0.0 109.205 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -150.15 86.69 1.43 Allowed 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.804 -173.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -76.26 90.67 3.17 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.477 0.711 . . . . 0.0 109.891 178.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.68 144.35 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.969 0.908 . . . . 0.0 110.028 178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.0 tp -103.39 38.44 1.78 Allowed 'General case' 0 CA--C 1.55 0.978 0 CA-C-O 122.134 0.968 . . . . 0.0 108.775 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.36 139.11 11.66 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.79 1.236 . . . . 0.0 108.126 -176.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.84 161.16 43.2 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-O 121.068 0.461 . . . . 0.0 111.202 -171.705 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 20.1 t -109.1 43.02 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.111 0 C-N-CA 124.401 1.08 . . . . 0.0 108.416 -178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.46 HD13 ' HG2' ' A' ' 42' ' ' GLU . 8.2 mt -106.75 49.85 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -88.52 83.08 6.82 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.434 HD23 ' HG2' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -113.53 -3.56 13.65 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.363 -176.374 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.0 t -60.93 148.95 38.01 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.767 0.827 . . . . 0.0 111.906 -178.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 49.0 t-80 -153.63 92.25 1.56 Allowed 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -67.68 95.56 0.5 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.306 1.042 . . . . 0.0 111.591 -172.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -89.49 105.51 17.84 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 108.617 -0.883 . . . . 0.0 108.617 170.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -68.9 138.24 54.5 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -80.24 26.18 0.37 Allowed 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.119 0.968 . . . . 0.0 113.104 -171.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -61.32 -66.19 0.57 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.55 1.14 . . . . 0.0 110.513 176.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -23.58 61.6 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.503 -178.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.8 mp0 -63.19 -49.24 75.03 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 172.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.75 -38.09 85.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.652 0.595 . . . . 0.0 111.414 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.64 -49.37 68.91 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.79 0.836 . . . . 0.0 111.436 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 34.4 mm -67.48 -43.41 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 123.309 0.643 . . . . 0.0 110.467 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.417 ' O ' ' HG ' ' A' ' 111' ' ' LEU . . . -57.83 -49.37 76.9 Favored 'General case' 0 N--CA 1.482 1.168 0 O-C-N 123.949 0.781 . . . . 0.0 111.143 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.38 -43.47 90.62 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.033 0.933 . . . . 0.0 109.604 -178.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 21.8 t -76.68 -14.08 59.99 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.115 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.11 -42.22 23.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 172.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 107' ' ' ALA . 87.7 mt -66.55 -37.98 86.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.555 177.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 55.69 49.98 15.25 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.339 1.055 . . . . 0.0 111.178 -174.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 27.5 p -110.44 87.99 7.0 Favored Pre-proline 0 CA--C 1.553 1.077 0 CA-C-N 114.999 -1.0 . . . . 0.0 109.782 178.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.513 ' HB2' HG13 ' A' ' 116' ' ' ILE . 75.5 Cg_endo -82.01 147.55 14.93 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.587 2.191 . . . . 0.0 111.973 177.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.573 ' HE3' ' HA ' ' A' ' 115' ' ' LYS . 0.2 OUTLIER -89.18 49.29 1.74 Allowed 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 123.667 0.787 . . . . 0.0 110.025 -178.012 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.516 HG12 ' H ' ' A' ' 121' ' ' ARG . 24.6 mt -82.14 64.91 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 CA-C-O 122.404 1.097 . . . . 0.0 108.84 178.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -149.91 -13.05 0.27 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.515 1.526 . . . . 0.0 109.379 -176.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -150.06 -59.53 0.2 Allowed 'General case' 0 C--N 1.35 0.59 0 C-N-CA 123.261 0.624 . . . . 0.0 110.866 -167.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -157.14 28.83 0.3 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.889 0.476 . . . . 0.0 112.068 -173.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -81.84 -96.84 0.46 Allowed Glycine 0 C--N 1.344 1.001 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 176.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.516 ' H ' HG12 ' A' ' 116' ' ' ILE . 7.5 mpt_? -126.56 27.73 6.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.748 0.819 . . . . 0.0 109.282 175.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.32 76.62 8.25 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-O 121.747 0.784 . . . . 0.0 110.481 -179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 37.3 tp -96.96 71.86 2.5 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.0 0.92 . . . . 0.0 108.737 175.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -81.42 137.54 35.66 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.59 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -99.81 42.98 1.08 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 172.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 54.0 ttp -65.56 122.13 16.52 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.157 0.983 . . . . 0.0 110.35 -178.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 48.9 m80 -123.54 103.8 8.66 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 177.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -78.55 165.31 23.86 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.247 1.019 . . . . 0.0 110.587 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.02 90.52 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.735 0.814 . . . . 0.0 110.544 172.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 22.3 m -90.3 -66.18 0.95 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.769 0.827 . . . . 0.0 110.599 -172.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.4 t -102.07 -5.88 24.01 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.081 0.553 . . . . 0.0 110.785 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.955 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.896 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.414 ' HG3' ' HB2' ' A' ' 25' ' ' LEU . 4.0 tp-100 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.8 tpp -52.72 -58.41 6.96 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.45 1.1 . . . . 0.0 113.235 -164.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.664 ' HG ' HD22 ' A' ' 25' ' ' LEU . 1.8 pt? -59.3 -36.88 76.4 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.772 0.829 . . . . 0.0 112.718 -177.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.664 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.2 mm? -66.55 -46.93 74.47 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.123 0.569 . . . . 0.0 110.333 177.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -65.75 -42.55 90.78 Favored 'General case' 0 N--CA 1.48 1.033 0 O-C-N 124.251 0.97 . . . . 0.0 110.882 -176.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -64.51 -52.58 57.07 Favored 'General case' 0 C--N 1.348 0.531 0 O-C-N 124.328 1.018 . . . . 0.0 111.001 -178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 40' ' ' LEU . 22.2 tp -57.41 -46.97 82.92 Favored 'General case' 0 C--N 1.364 1.227 0 O-C-N 124.065 0.853 . . . . 0.0 110.264 178.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -53.96 -39.72 66.21 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.573 1.149 . . . . 0.0 111.769 176.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -72.55 -40.43 66.68 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.635 -176.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.0 pt -98.88 2.17 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 123.672 0.789 . . . . 0.0 112.584 -172.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 77.1 p -112.57 -42.49 3.64 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.307 0.643 . . . . 0.0 109.454 168.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 107.57 -13.87 38.97 Favored Glycine 0 N--CA 1.468 0.781 0 CA-C-N 114.799 -1.091 . . . . 0.0 111.613 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.519 HD12 HD13 ' A' ' 58' ' ' LEU . 72.0 mt -75.16 110.04 9.25 Favored 'Isoleucine or valine' 0 C--N 1.35 0.602 0 C-N-CA 123.912 0.885 . . . . 0.0 110.332 -175.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -71.44 -32.73 68.68 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.057 0.943 . . . . 0.0 111.17 -179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -64.11 115.53 20.15 Favored Pre-proline 0 N--CA 1.481 1.097 0 C-N-CA 123.653 0.781 . . . . 0.0 111.53 -176.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.474 ' HA ' HD12 ' A' ' 40' ' ' LEU . 42.2 Cg_endo -62.59 -22.62 74.19 Favored 'Trans proline' 0 C--N 1.391 2.812 0 C-N-CA 123.579 2.853 . . . . 0.0 112.97 -179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.4 m -54.43 -53.68 50.96 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.884 0.874 . . . . 0.0 110.976 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -63.89 -33.53 75.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.677 -179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.609 ' HA ' HD23 ' A' ' 28' ' ' LEU . 46.2 mt -72.28 -47.1 52.67 Favored 'General case' 0 C--O 1.244 0.771 0 O-C-N 124.428 1.08 . . . . 0.0 111.038 -171.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -60.94 -54.42 45.28 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.709 0.63 . . . . 0.0 109.901 172.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.83 -30.15 68.75 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.876 0.735 . . . . 0.0 112.391 -174.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.34 -49.83 45.29 Favored 'General case' 0 C--N 1.35 0.619 0 C-N-CA 122.971 0.509 . . . . 0.0 110.317 174.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.505 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.4 mm? -59.04 -29.74 67.51 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 123.996 0.918 . . . . 0.0 111.246 177.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -71.65 -51.0 25.38 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.401 0.68 . . . . 0.0 109.794 174.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.83 -13.73 62.59 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.713 0.805 . . . . 0.0 112.434 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.9 m -104.4 4.27 33.18 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.551 0.74 . . . . 0.0 112.374 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.6 t30 70.66 -2.63 2.18 Favored 'General case' 0 CA--C 1.571 1.751 0 C-N-CA 124.579 1.152 . . . . 0.0 111.582 -176.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.18 -6.95 10.79 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-O 119.57 -0.572 . . . . 0.0 112.777 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -79.28 105.95 10.97 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.006 0.523 . . . . 0.0 110.201 -179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.473 ' O ' HG23 ' A' ' 55' ' ' VAL . 19.2 tt -65.24 -27.21 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.218 0 C-N-CA 122.914 0.485 . . . . 0.0 112.167 -173.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 36.3 m -66.01 -47.39 74.63 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 123.496 0.719 . . . . 0.0 110.685 177.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.425 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 21.1 mm-40 -60.9 -39.26 88.67 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.604 174.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.34 -41.54 89.42 Favored 'General case' 0 C--O 1.246 0.869 0 O-C-N 124.051 0.845 . . . . 0.0 111.856 178.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.473 HG23 ' O ' ' A' ' 51' ' ' ILE . 73.3 t -59.18 -50.09 81.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 123.723 0.64 . . . . 0.0 109.71 173.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m -56.7 -41.74 77.91 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 124.307 1.004 . . . . 0.0 111.482 -178.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 94.9 mt -74.1 -29.85 62.05 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.684 0.794 . . . . 0.0 111.898 -174.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.519 HD13 HD12 ' A' ' 34' ' ' ILE . 68.4 mt -84.17 -32.53 24.55 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 177.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.7 p -79.84 -18.78 49.97 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -76.15 -4.25 40.58 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -175.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.21 -37.44 74.82 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.387 0.675 . . . . 0.0 111.326 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -77.63 -11.54 59.88 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.794 0.837 . . . . 0.0 111.889 -179.207 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 37.7 t -88.55 -26.3 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.243 0.617 . . . . 0.0 109.682 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.85 102.77 5.64 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 177.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.525 ' HA ' ' H ' ' A' ' 67' ' ' SER . 13.7 pt-20 -67.66 153.54 94.87 Favored Pre-proline 0 CA--C 1.566 1.581 0 C-N-CA 123.854 0.862 . . . . 0.0 110.982 175.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -84.69 93.68 0.14 OUTLIER 'Cis proline' 0 C--N 1.387 2.581 0 CA-C-N 120.474 1.205 . . . . 0.0 113.302 2.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.525 ' H ' ' HA ' ' A' ' 65' ' ' GLU . 12.0 p -94.91 -74.0 0.56 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.997 0.919 . . . . 0.0 109.851 -177.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 179.4 145.61 0.18 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.866 1.267 . . . . 0.0 108.691 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -84.63 38.39 0.69 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.663 0.785 . . . . 0.0 111.279 177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.7 t -79.31 -178.55 6.28 Favored 'General case' 0 CA--C 1.557 1.225 0 C-N-CA 124.002 0.921 . . . . 0.0 110.835 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 20.7 m -52.52 117.95 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 C-N-CA 124.56 1.144 . . . . 0.0 112.183 178.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -141.03 95.16 2.8 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.953 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.0 t -94.52 176.04 6.44 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.261 0.624 . . . . 0.0 109.729 177.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -69.18 138.8 89.68 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 123.463 0.705 . . . . 0.0 111.496 -172.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -74.65 174.75 12.11 Favored 'Trans proline' 0 C--N 1.382 2.333 0 C-N-CA 123.081 2.521 . . . . 0.0 111.535 173.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.1 m 59.14 29.27 18.79 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.117 0.967 . . . . 0.0 110.827 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -64.05 -45.29 89.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.072 0.949 . . . . 0.0 110.393 -177.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -70.35 143.62 14.48 Favored 'Isoleucine or valine' 0 C--O 1.248 1.004 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.024 178.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -71.48 98.64 1.87 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.589 179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -72.22 -30.58 64.85 Favored Glycine 0 C--N 1.346 1.088 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.44 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 29.7 t 58.69 25.1 12.93 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.26 1.024 . . . . 0.0 110.891 -177.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -115.71 77.83 1.12 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.76 1.224 . . . . 0.0 108.204 -176.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -73.13 80.99 1.27 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.349 0.66 . . . . 0.0 109.786 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.422 HD22 ' N ' ' A' ' 84' ' ' ASN . 0.8 OUTLIER -76.56 95.96 4.02 Favored 'General case' 0 C--N 1.352 0.678 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 177.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -93.88 32.86 1.38 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.553 0.741 . . . . 0.0 110.152 178.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.21 100.41 1.68 Allowed 'General case' 0 C--N 1.348 0.515 0 C-N-CA 124.15 0.98 . . . . 0.0 109.565 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 39.0 t -65.24 122.18 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 O-C-N 124.197 0.936 . . . . 0.0 109.554 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -84.52 -24.72 29.22 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.012 0.525 . . . . 0.0 110.403 -178.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.78 108.53 12.28 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.232 0.613 . . . . 0.0 111.191 -177.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.541 ' HG2' ' H ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -145.14 170.44 16.22 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.515 1.126 . . . . 0.0 108.252 172.58 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 12.4 p -114.4 27.16 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 CA-C-O 122.585 1.183 . . . . 0.0 109.075 178.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.541 ' H ' ' HG2' ' A' ' 90' ' ' LYS . 47.5 mt -110.46 78.22 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.511 -176.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -162.34 87.71 0.63 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 114.375 -1.284 . . . . 0.0 107.566 166.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.426 HD23 ' H ' ' A' ' 94' ' ' LEU . 2.1 pt? -101.21 -30.83 11.32 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.913 -177.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.3 t -103.81 124.32 48.7 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 121.838 0.828 . . . . 0.0 111.823 -174.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -168.66 38.66 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.62 1.568 . . . . 0.0 106.942 174.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -78.07 -49.02 14.77 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 114.24 -1.345 . . . . 0.0 111.531 -168.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -70.41 110.69 5.47 Favored 'General case' 0 CA--C 1.552 1.022 0 O-C-N 123.982 0.802 . . . . 0.0 109.51 -178.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.417 ' HD2' HD12 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -81.56 145.66 30.54 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.101 -178.041 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.466 ' HA ' ' NE2' ' A' ' 103' ' ' GLN . 31.0 t70 -87.67 -1.32 57.88 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.378 0.671 . . . . 0.0 110.606 -178.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -53.6 -51.04 64.32 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.492 1.117 . . . . 0.0 111.726 -179.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.417 HD12 ' HD2' ' A' ' 99' ' ' LYS . 0.0 OUTLIER -76.59 -22.91 53.6 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -177.179 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.466 ' NE2' ' HA ' ' A' ' 100' ' ' ASP . 2.3 mp0 -61.1 -55.98 26.2 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 170.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.06 -35.14 79.75 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.635 -178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -69.57 -56.17 8.08 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.398 0.679 . . . . 0.0 111.414 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.7 mm -64.22 -40.49 89.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.226 0.61 . . . . 0.0 110.369 -178.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.25 -47.18 80.6 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.307 0.643 . . . . 0.0 111.601 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 49.9 tp -65.82 -31.57 72.6 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 122.702 0.401 . . . . 0.0 110.501 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.3 t -71.62 -33.61 69.11 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.548 0.739 . . . . 0.0 110.864 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 41.6 tp -71.43 -44.6 64.55 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.903 0.881 . . . . 0.0 111.022 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -71.38 -32.57 68.62 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 119.119 -0.467 . . . . 0.0 110.002 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 49.61 20.7 0.53 Allowed 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 126.876 2.07 . . . . 0.0 114.156 179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.9 p -128.24 120.74 21.28 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.199 1.0 . . . . 0.0 108.306 -178.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -73.45 75.63 2.92 Favored 'Trans proline' 0 C--N 1.376 2.004 0 C-N-CA 122.641 2.227 . . . . 0.0 111.366 174.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.407 ' HD3' HE21 ' A' ' 117' ' ' GLN . 2.3 tppp? 66.51 8.08 5.52 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 125.034 1.334 . . . . 0.0 112.385 177.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 42.9 mm -80.02 95.74 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.407 HE21 ' HD3' ' A' ' 115' ' ' LYS . 9.5 pt20 -122.49 62.06 0.98 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.651 0.78 . . . . 0.0 109.579 -177.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . 75.9 -24.94 0.21 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.868 1.267 . . . . 0.0 113.269 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -85.65 -22.48 27.89 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.835 0.854 . . . . 0.0 112.2 -175.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -82.31 -123.46 0.75 Allowed Glycine 0 C--N 1.354 1.575 0 O-C-N 123.178 0.299 . . . . 0.0 113.359 -173.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.96 -3.96 22.18 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 124.077 0.951 . . . . 0.0 112.998 -179.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.71 -21.46 66.53 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 125.045 1.338 . . . . 0.0 111.877 -178.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 1.6 tt 70.63 100.83 0.06 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 125.159 1.384 . . . . 0.0 108.532 -177.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -154.31 147.75 25.06 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.04 0.936 . . . . 0.0 108.731 179.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -75.09 83.98 2.31 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 174.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 4.1 ppp? -111.66 -29.25 7.79 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.221 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 27.3 t60 -95.66 92.07 6.42 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -76.06 104.6 6.67 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.042 0.537 . . . . 0.0 110.24 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.21 105.47 6.25 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 123.098 0.559 . . . . 0.0 110.603 -179.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 21.4 m -88.31 127.23 35.47 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.226 0.611 . . . . 0.0 109.727 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 30.0 t -82.99 -34.62 26.31 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.067 0.547 . . . . 0.0 110.336 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.261 1.024 . . . . 0.0 109.076 -177.161 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -59.21 -35.54 73.79 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 124.268 1.027 . . . . 0.0 112.861 -171.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.443 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.3 pt? -64.55 -39.57 94.0 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.481 0.713 . . . . 0.0 111.578 179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.95 -48.16 69.43 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.688 0.795 . . . . 0.0 110.161 175.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -62.09 -49.9 74.08 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.618 1.199 . . . . 0.0 110.978 -175.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.421 ' O ' HG12 ' A' ' 31' ' ' ILE . 7.9 mm100 -62.45 -56.33 19.2 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.462 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.513 HD22 HD23 ' A' ' 44' ' ' LEU . 20.5 tp -57.56 -45.26 85.37 Favored 'General case' 0 C--N 1.36 1.061 0 O-C-N 123.784 0.677 . . . . 0.0 110.685 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -55.6 -45.28 77.47 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.77 0.828 . . . . 0.0 111.243 176.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.25 -34.96 79.18 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 123.296 0.638 . . . . 0.0 111.29 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 27' ' ' GLN . 10.8 pt -104.8 2.42 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -173.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 68.1 p -112.33 -50.48 2.9 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.511 0.672 . . . . 0.0 109.668 167.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 101.49 22.53 10.31 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.927 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.441 HD12 HD13 ' A' ' 58' ' ' LEU . 62.4 mt -101.59 122.76 54.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.242 0.617 . . . . 0.0 110.28 -179.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -81.59 -26.45 34.91 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.174 0.99 . . . . 0.0 111.91 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -67.13 112.54 10.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.082 0.553 . . . . 0.0 110.525 178.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -66.89 -22.01 49.49 Favored 'Trans proline' 0 C--N 1.385 2.456 0 C-N-CA 122.906 2.404 . . . . 0.0 111.872 179.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.9 m -57.28 -52.25 66.1 Favored 'General case' 0 C--N 1.354 0.793 0 O-C-N 124.233 0.958 . . . . 0.0 110.188 176.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -60.72 -40.84 93.79 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 124.193 0.933 . . . . 0.0 111.584 178.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.511 ' HA ' HD23 ' A' ' 28' ' ' LEU . 66.0 mt -68.15 -46.28 71.23 Favored 'General case' 0 C--O 1.246 0.887 0 O-C-N 124.083 0.864 . . . . 0.0 111.488 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 71.2 m-70 -64.96 -51.16 63.31 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.328 176.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -58.0 -33.08 68.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.285 0.634 . . . . 0.0 112.18 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.11 -48.88 61.39 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 123.747 0.654 . . . . 0.0 110.419 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.513 HD23 HD22 ' A' ' 28' ' ' LEU . 3.3 mm? -61.1 -29.64 69.88 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.903 0.881 . . . . 0.0 111.385 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -76.27 -48.19 21.08 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.793 0.837 . . . . 0.0 110.704 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.89 -35.3 80.26 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.784 0.834 . . . . 0.0 111.094 -178.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.0 m -87.77 1.92 52.61 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.649 0.78 . . . . 0.0 111.571 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.457 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER 66.44 12.16 8.5 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.848 1.259 . . . . 0.0 112.6 174.901 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.57 -11.87 11.15 Favored Glycine 0 C--N 1.346 1.13 0 CA-C-O 119.805 -0.442 . . . . 0.0 112.865 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -77.97 104.88 8.81 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 121.293 0.568 . . . . 0.0 110.483 178.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.503 ' O ' HG23 ' A' ' 55' ' ' VAL . 18.0 tt -64.04 -26.17 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.014 -177.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.3 m -65.13 -52.77 53.26 Favored 'General case' 0 C--O 1.251 1.179 0 C-N-CA 123.685 0.794 . . . . 0.0 110.908 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.477 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 14.3 mm100 -62.15 -37.93 87.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.815 174.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.72 -44.36 81.53 Favored 'General case' 0 C--O 1.247 0.948 0 O-C-N 124.114 0.884 . . . . 0.0 111.848 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 51' ' ' ILE . 59.6 t -59.31 -50.36 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 122.918 0.487 . . . . 0.0 109.806 172.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.9 m -56.99 -35.75 69.56 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.333 1.021 . . . . 0.0 112.169 -175.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 76.7 mt -72.89 -44.02 61.78 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 122.939 0.495 . . . . 0.0 110.395 178.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.441 HD13 HD12 ' A' ' 34' ' ' ILE . 58.6 mt -78.03 -10.15 59.47 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -177.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.4 p -110.21 6.55 22.72 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.86 0.464 . . . . 0.0 110.825 175.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -78.93 -30.53 44.73 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.969 0.507 . . . . 0.0 111.152 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.444 ' HA ' ' HE2' ' A' ' 64' ' ' LYS . 0.0 OUTLIER -61.77 -20.74 63.91 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -172.008 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -82.55 -18.41 41.5 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.991 0.916 . . . . 0.0 111.95 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.8 p -123.19 3.0 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 123.752 0.821 . . . . 0.0 110.09 -177.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 61' ' ' GLU . 23.8 ttmm -68.1 88.81 0.29 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.445 1.098 . . . . 0.0 110.819 -176.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -126.6 134.86 26.49 Favored Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.782 . . . . 0.0 109.23 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -75.62 165.65 85.1 Favored 'Cis proline' 0 C--N 1.377 2.077 0 CA-C-N 119.787 0.96 . . . . 0.0 113.28 3.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 35.2 t -72.78 168.95 17.75 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.759 0.824 . . . . 0.0 110.88 178.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -137.3 111.35 8.35 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 -178.294 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -70.06 105.91 3.05 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.556 0.742 . . . . 0.0 110.41 -179.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 28.3 p -65.76 152.62 43.88 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.153 0.981 . . . . 0.0 111.256 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.5 p -53.49 137.52 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 124.171 0.989 . . . . 0.0 112.232 -176.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -81.34 54.69 2.37 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.129 0.972 . . . . 0.0 110.928 -179.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.8 t -76.44 86.46 3.18 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-O 122.28 1.038 . . . . 0.0 110.641 -178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -72.51 146.03 88.3 Favored Pre-proline 0 CA--C 1.546 0.817 0 CA-C-N 114.618 -1.174 . . . . 0.0 109.829 178.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -58.13 116.76 3.47 Favored 'Trans proline' 0 C--N 1.382 2.336 0 C-N-CA 122.707 2.272 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.7 p -67.78 -176.51 0.66 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.627 0.771 . . . . 0.0 111.391 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -68.91 78.37 0.31 Allowed 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.371 0.669 . . . . 0.0 111.192 -174.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.8 p -91.16 95.89 5.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-O 122.225 1.012 . . . . 0.0 108.666 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -72.11 100.01 2.44 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.282 -174.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -172.5 -68.66 0.04 OUTLIER Glycine 0 C--N 1.341 0.86 0 N-CA-C 109.492 -1.443 . . . . 0.0 109.492 179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 27.3 t -82.03 -29.58 31.89 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 171.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.75 -24.07 61.71 Favored 'General case' 0 C--N 1.354 0.774 0 C-N-CA 123.352 0.661 . . . . 0.0 110.49 174.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -75.58 107.74 7.93 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.756 177.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -91.18 95.0 9.83 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -144.47 105.63 4.21 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.401 0.681 . . . . 0.0 109.307 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -78.22 131.37 37.1 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.541 0.736 . . . . 0.0 109.565 177.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 56.7 t -90.37 120.72 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -91.3 80.66 5.53 Favored 'General case' 0 C--O 1.24 0.6 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -177.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -139.86 120.54 14.28 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.099 -174.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.92 157.31 37.57 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.212 0.605 . . . . 0.0 109.85 174.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.7 t -121.87 34.52 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 CA-C-O 122.294 1.045 . . . . 0.0 108.227 174.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 48.3 mt -86.23 77.09 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -76.41 85.02 3.15 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.563 -1.198 . . . . 0.0 109.232 172.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.84 36.84 3.07 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 176.115 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.9 p -88.83 -8.07 55.02 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.222 -1.354 . . . . 0.0 110.497 173.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -118.06 97.81 6.0 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.602 0.761 . . . . 0.0 109.673 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -112.46 -30.69 7.06 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.341 0.656 . . . . 0.0 109.752 173.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -96.92 137.17 36.41 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.625 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -100.6 143.9 30.22 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -92.76 5.52 50.85 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.481 1.112 . . . . 0.0 112.181 -173.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -68.87 -45.64 70.48 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.074 0.55 . . . . 0.0 111.614 -170.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -71.39 -32.35 68.35 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.463 0.705 . . . . 0.0 110.381 -178.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -66.71 -44.64 81.11 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.97 176.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.22 -35.17 79.03 Favored 'General case' 0 CA--C 1.544 0.741 0 O-C-N 124.104 0.878 . . . . 0.0 111.151 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.48 -57.39 8.37 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.675 0.79 . . . . 0.0 111.073 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 37.0 mm -61.6 -46.06 97.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.112 0.965 . . . . 0.0 110.966 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.32 82.31 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.131 0.895 . . . . 0.0 111.149 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.35 -49.44 77.79 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.746 0.654 . . . . 0.0 109.432 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 45.2 m -59.38 -38.24 79.98 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.964 0.79 . . . . 0.0 111.925 -178.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 70.0 mt -81.72 -18.53 44.05 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.531 0.733 . . . . 0.0 111.812 -179.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 80.1 mt -85.37 -21.26 28.94 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.08 0.552 . . . . 0.0 110.621 172.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -76.21 -13.82 60.16 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.333 0.653 . . . . 0.0 110.713 171.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 116' ' ' ILE . 32.9 m -90.01 104.03 7.7 Favored Pre-proline 0 CA--C 1.556 1.199 0 C-N-CA 124.239 1.016 . . . . 0.0 110.154 176.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -85.13 84.18 1.41 Allowed 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 123.199 2.599 . . . . 0.0 111.211 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? 69.88 13.22 7.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.515 1.126 . . . . 0.0 111.812 -179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.447 ' O ' ' HB3' ' A' ' 113' ' ' SER . 10.9 mm -118.17 87.71 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -57.11 -39.59 75.39 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.509 0.723 . . . . 0.0 112.235 -177.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -178.24 172.28 1.56 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 125.255 1.422 . . . . 0.0 108.768 177.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 21.2 t70 70.25 -71.21 0.13 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 124.827 1.251 . . . . 0.0 112.431 173.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 149.84 116.89 0.82 Allowed Glycine 0 C--N 1.345 1.039 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -110.48 -62.46 1.52 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.057 0.543 . . . . 0.0 109.634 -178.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.0 t70 63.52 11.29 5.52 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 125.235 1.414 . . . . 0.0 112.8 177.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -73.3 -37.54 66.18 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.947 0.899 . . . . 0.0 109.715 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -67.78 105.4 1.93 Allowed 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.324 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 30.7 ttm180 -164.3 109.14 0.98 Allowed 'General case' 0 C--O 1.237 0.419 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 62.1 mtt -70.13 96.65 1.09 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.229 0.612 . . . . 0.0 109.393 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -79.6 82.13 5.76 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.542 0.686 . . . . 0.0 110.355 -175.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -24.8 56.53 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.564 174.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -75.58 118.3 18.27 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.718 0.807 . . . . 0.0 110.144 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 72.0 m -129.19 136.47 50.19 Favored 'General case' 0 C--O 1.242 0.67 0 C-N-CA 124.419 1.088 . . . . 0.0 108.595 177.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -70.62 112.4 6.84 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.555 0.742 . . . . 0.0 109.661 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.938 0 C-N-CA 123.363 0.665 . . . . 0.0 109.68 178.365 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 . . . . . 0 N--CA 1.485 1.28 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 53.5 ttm -56.34 -53.31 58.77 Favored 'General case' 0 C--N 1.364 1.228 0 C-N-CA 124.203 1.001 . . . . 0.0 112.41 -169.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.494 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -51.57 -41.28 61.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.035 0.934 . . . . 0.0 112.605 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.494 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.5 mm? -62.99 -52.36 63.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.679 0.792 . . . . 0.0 109.961 176.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -67.37 -39.97 85.72 Favored 'General case' 0 N--CA 1.483 1.188 0 O-C-N 124.218 0.949 . . . . 0.0 111.723 -172.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.442 ' O ' HG12 ' A' ' 31' ' ' ILE . 18.7 mm100 -65.52 -50.42 65.32 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.488 0.715 . . . . 0.0 110.218 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.586 HD23 ' HA ' ' A' ' 40' ' ' LEU . 16.1 tp -61.55 -45.09 95.65 Favored 'General case' 0 C--N 1.357 0.919 0 O-C-N 123.878 0.737 . . . . 0.0 110.526 179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 77.1 ttt180 -56.77 -37.78 71.55 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 124.595 1.158 . . . . 0.0 111.746 178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -64.59 -51.08 64.59 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.893 0.877 . . . . 0.0 110.496 177.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 27' ' ' GLN . 5.8 pt -96.48 2.38 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -169.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.462 HG21 HD12 ' A' ' 58' ' ' LEU . 73.1 p -110.55 -37.97 5.32 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 167.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 100.4 -9.07 58.99 Favored Glycine 0 C--N 1.342 0.913 0 CA-C-N 114.905 -1.043 . . . . 0.0 112.012 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.597 HD12 HD13 ' A' ' 58' ' ' LEU . 64.9 mt -79.58 112.17 17.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.491 0 C-N-CA 123.641 0.776 . . . . 0.0 110.409 -174.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -73.11 -29.21 62.75 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.717 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.425 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 20.0 t70 -63.09 115.33 16.76 Favored Pre-proline 0 C--N 1.35 0.611 0 C-N-CA 124.0 0.92 . . . . 0.0 111.094 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.443 ' HA ' HD12 ' A' ' 40' ' ' LEU . 58.2 Cg_endo -67.89 -25.92 38.48 Favored 'Trans proline' 0 C--N 1.381 2.287 0 C-N-CA 122.85 2.367 . . . . 0.0 112.744 -176.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 48.9 m -63.34 -46.6 85.82 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.677 0.791 . . . . 0.0 111.38 -175.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.4 m-30 -61.07 -34.56 75.09 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.576 0.75 . . . . 0.0 111.511 174.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.586 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.6 mt -70.96 -42.06 70.27 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 123.856 0.723 . . . . 0.0 110.874 -177.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.8 m-70 -66.68 -48.08 70.43 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.934 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.03 -27.33 65.57 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.233 0.333 . . . . 0.0 111.497 -177.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.09 -37.37 69.58 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.629 0.371 . . . . 0.0 110.441 172.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.503 HD23 HD22 ' A' ' 28' ' ' LEU . 1.8 mm? -73.13 -23.96 60.54 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.727 0.811 . . . . 0.0 109.501 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -74.37 -51.68 14.36 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.804 1.241 . . . . 0.0 110.3 174.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.13 -16.52 63.67 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.817 -177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 92.6 p -101.2 -7.19 23.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.303 0.641 . . . . 0.0 111.76 176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 64.54 22.62 12.71 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.532 1.133 . . . . 0.0 111.583 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.76 -7.54 31.64 Favored Glycine 0 C--N 1.348 1.245 0 CA-C-N 116.134 -0.485 . . . . 0.0 112.933 178.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -77.52 112.21 14.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.018 0.527 . . . . 0.0 109.718 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.576 ' O ' HG23 ' A' ' 55' ' ' VAL . 9.3 tp -59.72 -42.08 87.48 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.997 -175.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 28.8 m -64.02 -46.43 84.52 Favored 'General case' 0 C--N 1.353 0.743 0 C-N-CA 124.07 0.948 . . . . 0.0 111.206 -173.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -63.14 -42.98 99.58 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.767 176.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.35 -42.62 82.37 Favored 'General case' 0 C--O 1.247 0.949 0 O-C-N 123.906 0.754 . . . . 0.0 111.512 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 51' ' ' ILE . 47.0 t -60.17 -49.35 84.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.308 0.643 . . . . 0.0 109.773 175.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.4 t -62.59 -35.47 79.64 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 123.857 0.723 . . . . 0.0 112.025 -177.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.2 mt -76.59 -27.0 55.64 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.565 0.746 . . . . 0.0 111.539 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.597 HD13 HD12 ' A' ' 34' ' ' ILE . 72.1 mt -86.85 -38.94 16.32 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 173.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.438 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 77.5 p -76.62 -2.33 32.07 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.292 0.637 . . . . 0.0 110.896 178.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -51.94 -33.87 39.31 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.028 1.331 . . . . 0.0 111.393 167.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -54.54 -36.72 64.58 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.793 1.237 . . . . 0.0 113.533 -177.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' A' ' 59' ' ' THR . 12.2 ptt180 -75.25 -23.63 57.52 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.602 0.761 . . . . 0.0 110.391 -174.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.3 t -96.14 -28.76 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.702 0.801 . . . . 0.0 110.022 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -72.64 92.95 1.57 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.919 0.888 . . . . 0.0 110.874 -166.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.401 ' HA ' ' N ' ' A' ' 67' ' ' SER . 65.7 mm-40 -63.06 146.22 95.97 Favored Pre-proline 0 CA--C 1.554 1.115 0 C-N-CA 124.063 0.945 . . . . 0.0 112.606 -175.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -80.64 105.43 0.72 Allowed 'Cis proline' 0 C--N 1.38 2.223 0 C-N-CA 124.358 -1.101 . . . . 0.0 112.42 -2.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.401 ' N ' ' HA ' ' A' ' 65' ' ' GLU . 45.0 m -80.59 148.59 30.24 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.845 0.458 . . . . 0.0 110.594 177.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -78.82 111.56 15.09 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 173.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -62.82 116.46 5.27 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.52 0.676 . . . . 0.0 110.202 177.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 33.6 p -86.16 -170.99 3.35 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 124.085 0.954 . . . . 0.0 111.188 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.446 HG22 ' H ' ' A' ' 73' ' ' THR . 8.3 p -64.37 129.69 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.284 0 C-N-CA 122.635 0.374 . . . . 0.0 110.522 176.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -99.58 3.83 45.55 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.419 0.687 . . . . 0.0 111.713 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.446 ' H ' HG22 ' A' ' 71' ' ' VAL . 54.4 m -64.59 129.66 40.67 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.432 0.693 . . . . 0.0 111.384 178.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.55 145.46 98.28 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-O 119.028 -0.51 . . . . 0.0 110.176 176.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -53.76 115.68 2.5 Favored 'Trans proline' 0 C--N 1.379 2.141 0 C-N-CA 122.782 2.321 . . . . 0.0 112.434 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.2 t -64.46 108.19 1.58 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.363 1.065 . . . . 0.0 109.956 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -155.79 36.07 0.35 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.345 0.658 . . . . 0.0 110.771 -176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 97.3 t -70.95 120.95 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.019 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -78.3 89.63 4.34 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.808 0.843 . . . . 0.0 109.887 179.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -81.99 -28.99 39.53 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 111.515 -0.634 . . . . 0.0 111.515 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 46.1 t -116.11 83.1 1.89 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.657 1.183 . . . . 0.0 108.9 178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.42 -50.75 4.86 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 124.207 1.003 . . . . 0.0 110.029 177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -161.0 132.8 5.74 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.241 1.016 . . . . 0.0 109.785 177.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -89.33 94.57 9.95 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 174.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -112.64 99.3 7.83 Favored 'General case' 0 C--O 1.244 0.786 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 177.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -70.2 132.29 45.53 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.747 0.419 . . . . 0.0 110.191 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.38 111.19 7.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 176.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.24 89.43 5.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 176.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.49 152.89 37.2 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 114.823 -1.08 . . . . 0.0 111.185 -179.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.405 ' HG2' ' H ' ' A' ' 92' ' ' ILE . 0.0 OUTLIER -138.9 163.98 30.89 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 122.431 0.292 . . . . 0.0 110.78 -171.11 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 14.8 t -127.78 44.71 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 171.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.405 ' H ' ' HG2' ' A' ' 90' ' ' LYS . 38.9 mm -84.9 -9.95 11.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.146 177.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.24 65.03 0.81 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.066 1.346 . . . . 0.0 111.266 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -116.86 78.36 1.2 Allowed 'General case' 0 C--O 1.242 0.682 0 N-CA-C 107.015 -1.476 . . . . 0.0 107.015 -176.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 43.7 p -75.62 94.48 3.2 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.388 -0.824 . . . . 0.0 108.903 176.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -56.07 129.71 41.05 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.489 0.716 . . . . 0.0 110.719 -178.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -64.62 102.79 0.6 Allowed 'General case' 0 CA--C 1.537 0.46 0 O-C-N 123.73 0.644 . . . . 0.0 110.408 -175.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.541 ' HB3' HD11 ' A' ' 102' ' ' LEU . 19.6 t-20 -77.61 -176.65 4.4 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -60.21 146.17 44.55 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.099 0.409 . . . . 0.0 109.96 176.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -52.41 -19.64 2.31 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 125.18 1.392 . . . . 0.0 112.92 -178.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -36.81 -65.89 0.26 Allowed 'General case' 0 C--O 1.247 0.925 0 C-N-CA 126.902 2.081 . . . . 0.0 113.881 177.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.541 HD11 ' HB3' ' A' ' 98' ' ' ASN . 0.0 OUTLIER -76.36 -33.07 58.94 Favored 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 119.156 -0.45 . . . . 0.0 112.045 -173.446 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -59.73 -41.51 91.09 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.198 0.454 . . . . 0.0 109.91 174.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.99 -46.33 78.4 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.291 179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.31 -44.49 96.39 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.312 1.008 . . . . 0.0 112.345 -177.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 102' ' ' LEU . 49.0 mm -72.48 -45.27 60.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.443 0.697 . . . . 0.0 110.688 -176.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.57 -28.13 65.71 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 122.949 0.5 . . . . 0.0 111.289 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 33.2 tp -71.01 -46.09 62.81 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.212 0.605 . . . . 0.0 109.39 175.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -58.38 -36.03 72.91 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.768 0.667 . . . . 0.0 110.813 175.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.4 tt -65.14 -49.43 69.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.452 1.101 . . . . 0.0 110.115 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.7 pp -71.78 -34.96 69.87 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.168 0.293 . . . . 0.0 111.295 -175.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.07 -38.85 63.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.119 0.567 . . . . 0.0 112.102 -177.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.8 p -66.68 142.09 97.33 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.584 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -55.56 135.72 70.65 Favored 'Trans proline' 0 C--N 1.38 2.188 0 C-N-CA 122.331 2.02 . . . . 0.0 111.972 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.419 ' HE3' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -66.97 -23.64 65.97 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.745 0.818 . . . . 0.0 110.274 178.681 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 45.7 mm -68.97 108.18 1.6 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.843 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.347 168.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -103.89 6.64 36.56 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.676 0.79 . . . . 0.0 110.545 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.456 ' O ' ' HG2' ' A' ' 121' ' ' ARG . . . -151.42 93.8 1.94 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.115 0.966 . . . . 0.0 109.606 -177.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 56.27 -78.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 126.093 1.757 . . . . 0.0 113.487 172.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -174.67 39.14 0.12 Allowed Glycine 0 C--N 1.342 0.877 0 N-CA-C 110.405 -1.078 . . . . 0.0 110.405 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 118' ' ' ALA . 26.9 mmm180 -68.71 -46.03 70.05 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.568 0.747 . . . . 0.0 111.593 -174.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.9 t70 73.71 -13.87 0.7 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 124.913 1.285 . . . . 0.0 112.755 177.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -95.37 95.08 8.22 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 -178.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -163.39 145.3 9.7 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.831 0.852 . . . . 0.0 109.627 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 62.01 28.54 17.3 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 21.0 ptt? -71.52 88.72 0.93 Allowed 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 122.314 1.054 . . . . 0.0 111.415 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -135.73 130.92 34.9 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.216 1.006 . . . . 0.0 108.336 174.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -147.01 -57.31 0.26 Allowed 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -175.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -143.75 97.34 3.05 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.733 0.813 . . . . 0.0 109.542 179.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 41.5 m -72.35 85.1 1.09 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.268 0.627 . . . . 0.0 109.357 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 18.0 m -94.86 -55.65 3.03 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.606 0.762 . . . . 0.0 110.062 -178.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.946 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.781 -176.667 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' A' ' 25' ' ' LEU . 19.0 tp60 . . . . . 0 N--CA 1.485 1.29 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.2 tpt -54.19 -51.58 63.93 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 124.437 1.095 . . . . 0.0 111.867 -173.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.635 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.2 pt? -57.42 -35.44 70.08 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 124.174 0.989 . . . . 0.0 112.718 178.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.635 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.9 mm? -68.83 -46.48 68.46 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -69.55 -39.01 77.7 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 124.292 0.995 . . . . 0.0 110.529 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.2 mm100 -62.26 -53.21 58.41 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.304 1.042 . . . . 0.0 110.611 178.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 40' ' ' LEU . 19.0 tp -58.15 -47.92 81.86 Favored 'General case' 0 C--N 1.36 1.043 0 O-C-N 123.862 0.726 . . . . 0.0 110.349 178.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -53.02 -42.23 65.48 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.764 1.225 . . . . 0.0 111.404 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -65.66 -46.47 79.04 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.041 -179.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.5 pt -96.02 2.33 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 113.512 0.931 . . . . 0.0 113.512 -171.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.515 HG21 HD12 ' A' ' 58' ' ' LEU . 69.1 p -110.0 -41.78 4.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.049 0.54 . . . . 0.0 109.831 169.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.61 7.18 59.2 Favored Glycine 0 C--N 1.343 0.949 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.678 -176.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.572 HD12 HD13 ' A' ' 58' ' ' LEU . 79.0 mt -95.74 110.08 23.72 Favored 'Isoleucine or valine' 0 C--N 1.348 0.514 0 C-N-CA 124.053 0.941 . . . . 0.0 109.306 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -77.5 -17.74 57.7 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.9 0.88 . . . . 0.0 111.107 177.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 3.0 m-20 -65.19 108.08 1.84 Allowed Pre-proline 0 CA--C 1.547 0.846 0 C-N-CA 124.997 1.319 . . . . 0.0 110.011 -177.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.28 -26.75 35.28 Favored 'Trans proline' 0 C--N 1.383 2.36 0 C-N-CA 123.114 2.543 . . . . 0.0 112.384 -171.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 16.7 t -62.39 -47.83 82.43 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 123.025 0.53 . . . . 0.0 109.858 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -57.89 -36.15 72.01 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.07 0.856 . . . . 0.0 111.492 176.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.528 ' HA ' HD23 ' A' ' 28' ' ' LEU . 59.7 mt -71.22 -51.12 26.47 Favored 'General case' 0 CA--C 1.547 0.828 0 O-C-N 123.972 0.795 . . . . 0.0 111.216 -174.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -60.62 -42.35 96.68 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.237 0.615 . . . . 0.0 111.585 174.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.487 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 40.4 mt-10 -65.99 -35.59 80.99 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.119 0.568 . . . . 0.0 112.144 -179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -70.65 -44.77 66.43 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 123.536 0.523 . . . . 0.0 110.572 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.55 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.7 mm? -61.67 -35.55 78.29 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 124.187 0.929 . . . . 0.0 110.172 176.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.487 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 2.7 tmmm? -68.38 -45.29 73.15 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.843 0.857 . . . . 0.0 110.174 175.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.95 -17.97 63.34 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.789 0.836 . . . . 0.0 112.018 -176.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 77.4 p -103.72 0.76 30.96 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 123.735 0.814 . . . . 0.0 111.507 178.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 15.0 m120 65.0 14.69 9.52 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.963 1.305 . . . . 0.0 112.435 -178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.59 12.46 Favored Glycine 0 C--N 1.353 1.472 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.873 179.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -79.14 99.26 6.89 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 117.571 0.685 . . . . 0.0 109.521 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 55' ' ' VAL . 17.5 tt -61.05 -29.29 45.4 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.306 0.642 . . . . 0.0 112.518 -172.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 26.8 m -64.78 -47.73 77.06 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.896 0.478 . . . . 0.0 110.608 177.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -63.37 -35.67 81.16 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.562 176.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.5 -43.78 89.22 Favored 'General case' 0 C--O 1.25 1.126 0 O-C-N 124.118 0.886 . . . . 0.0 111.274 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 51' ' ' ILE . 41.1 t -59.0 -51.84 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.466 174.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.7 t -57.71 -39.66 77.75 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.949 1.405 . . . . 0.0 111.195 -175.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 80.8 mt -74.72 -29.94 61.35 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.139 0.576 . . . . 0.0 111.808 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.572 HD13 HD12 ' A' ' 34' ' ' ILE . 72.5 mt -76.26 -38.08 56.73 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 123.239 0.337 . . . . 0.0 111.821 173.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 40.3 p -86.05 -28.3 24.2 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -172.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.477 ' HA ' HG12 ' A' ' 63' ' ' VAL . 39.2 m-20 -67.79 -21.92 65.21 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -59.27 -37.77 78.45 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.228 0.611 . . . . 0.0 111.359 175.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -98.54 -9.34 25.07 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -176.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.477 HG12 ' HA ' ' A' ' 60' ' ' ASP . 9.6 p -125.26 16.73 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 CA-C-N 118.345 0.52 . . . . 0.0 111.103 -177.159 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -65.45 98.22 0.34 Allowed 'General case' 0 CA--C 1.549 0.91 0 CA-C-O 121.619 0.723 . . . . 0.0 111.016 176.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -135.4 114.43 11.43 Favored Pre-proline 0 CA--C 1.549 0.921 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 173.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -72.55 138.31 54.08 Favored 'Cis proline' 0 C--N 1.387 2.603 0 CA-C-N 119.861 0.986 . . . . 0.0 113.676 6.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.1 t -84.4 -3.13 58.13 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.43 1.092 . . . . 0.0 112.063 -174.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 -64.8 142.96 58.25 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.373 0.669 . . . . 0.0 109.848 177.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -69.95 108.12 3.88 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.265 0.626 . . . . 0.0 110.7 -175.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.1 t -74.76 173.29 10.74 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.711 0.804 . . . . 0.0 110.501 175.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 18.2 m -81.28 61.35 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 CA-C-O 121.9 0.857 . . . . 0.0 110.685 174.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -79.98 69.6 6.39 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.257 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 m -147.28 111.87 5.29 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -104.43 151.81 39.22 Favored Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 123.758 0.823 . . . . 0.0 110.771 -176.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -57.32 122.88 12.56 Favored 'Trans proline' 0 C--N 1.381 2.24 0 C-N-CA 123.067 2.511 . . . . 0.0 111.644 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.9 m -101.97 110.12 22.02 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.538 0.735 . . . . 0.0 110.075 178.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -80.2 -16.8 54.01 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.686 0.794 . . . . 0.0 111.258 178.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.17 109.35 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 123.52 0.728 . . . . 0.0 110.7 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -73.76 109.97 7.69 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.383 0.673 . . . . 0.0 109.253 177.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -61.39 -27.01 67.06 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.75 0.656 . . . . 0.0 113.112 178.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 78.4 p 49.59 42.24 22.73 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.406 1.482 . . . . 0.0 111.952 175.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.31 72.14 5.29 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.316 -171.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -118.22 115.16 24.2 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 109.724 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -130.8 103.81 6.8 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.328 0.651 . . . . 0.0 109.644 178.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -106.99 104.65 14.37 Favored 'General case' 0 C--O 1.244 0.806 0 C-N-CA 123.584 0.754 . . . . 0.0 109.426 176.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -144.68 124.12 13.13 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.706 0.802 . . . . 0.0 109.534 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.51 140.36 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 168.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 28.3 tp -96.63 46.65 1.06 Allowed 'General case' 0 CA--C 1.55 0.974 0 CA-C-O 122.521 1.153 . . . . 0.0 108.435 178.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -132.13 148.83 52.5 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 114.518 -1.219 . . . . 0.0 109.743 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.4 tpmt? -76.64 134.21 39.37 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.861 0.725 . . . . 0.0 109.59 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 15.6 m -103.79 51.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 121.586 0.708 . . . . 0.0 110.927 -172.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 69.4 mt -63.61 -31.58 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.836 176.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 103.39 0.1 Allowed 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.983 0.913 . . . . 0.0 110.362 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -175.18 -31.43 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.961 1.305 . . . . 0.0 108.044 -171.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 38.8 p -57.49 93.73 0.01 OUTLIER 'General case' 0 C--N 1.362 1.126 0 C-N-CA 123.876 0.87 . . . . 0.0 111.56 -178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -70.57 -41.16 72.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.986 0.914 . . . . 0.0 109.776 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -81.09 157.24 25.45 Favored 'General case' 0 C--O 1.245 0.845 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.33 174.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -84.12 172.62 11.78 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.713 179.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -103.2 153.39 20.41 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.524 0.73 . . . . 0.0 109.282 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.501 ' HA ' ' NE2' ' A' ' 103' ' ' GLN . 24.9 t70 -83.65 65.98 8.76 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 170.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -104.15 -73.82 0.66 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-N 114.151 -1.386 . . . . 0.0 109.907 -170.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.418 ' H ' HD13 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -70.16 -20.89 63.12 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.028 0.531 . . . . 0.0 111.579 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.501 ' NE2' ' HA ' ' A' ' 100' ' ' ASP . 1.0 OUTLIER -59.58 -54.79 42.47 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 171.665 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.4 -28.93 65.46 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 114.932 -1.031 . . . . 0.0 111.407 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.415 ' HB3' ' HA ' ' A' ' 102' ' ' LEU . . . -69.15 -50.9 43.6 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.453 0.701 . . . . 0.0 111.381 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.4 mm -67.18 -41.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.422 0.689 . . . . 0.0 109.943 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.96 -50.14 74.41 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.269 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 54.6 tp -68.54 -41.01 80.47 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.482 0.713 . . . . 0.0 111.542 -179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -65.56 -41.44 92.95 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.975 0.51 . . . . 0.0 111.367 -176.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -82.44 -15.14 53.67 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.898 178.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -72.58 -46.98 51.69 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 170.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -84.71 -2.5 57.66 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.33 0.652 . . . . 0.0 112.464 -174.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.2 m -55.16 148.43 30.26 Favored Pre-proline 0 N--CA 1.487 1.384 0 CA-C-O 118.694 -0.67 . . . . 0.0 110.728 174.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -53.28 89.65 0.03 OUTLIER 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.84 3.026 . . . . 0.0 112.678 -174.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.516 ' HA ' HH21 ' A' ' 121' ' ' ARG . 4.1 tppp? -74.73 121.36 21.61 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.669 -174.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.511 ' HB ' ' HG3' ' A' ' 121' ' ' ARG . 10.7 tp -99.98 152.37 4.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -177.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -115.5 -37.69 3.94 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 175.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -173.93 128.13 0.39 Allowed 'General case' 0 C--O 1.241 0.638 0 C-N-CA 123.709 0.804 . . . . 0.0 109.41 177.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.9 t70 67.94 99.74 0.05 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.683 1.193 . . . . 0.0 111.164 176.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 162.56 -120.33 0.94 Allowed Glycine 0 C--N 1.343 0.966 0 N-CA-C 111.248 -0.741 . . . . 0.0 111.248 177.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.516 HH21 ' HA ' ' A' ' 115' ' ' LYS . 5.0 ppt_? -73.02 -7.18 50.04 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 117.425 0.612 . . . . 0.0 110.808 176.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -56.2 -28.84 59.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.847 1.259 . . . . 0.0 111.066 167.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 5.4 tt -75.99 79.9 2.86 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -99.42 -12.39 20.29 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.493 1.117 . . . . 0.0 108.316 165.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -139.43 158.08 44.76 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 125.214 1.405 . . . . 0.0 108.409 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 56.4 mtt -118.75 89.27 3.09 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.236 0.614 . . . . 0.0 109.424 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -89.79 131.11 35.91 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -157.97 139.44 13.64 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.722 0.809 . . . . 0.0 109.716 -177.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -103.39 113.78 27.54 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.972 0.909 . . . . 0.0 109.349 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 8.4 t -95.4 109.91 22.02 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 121.512 0.673 . . . . 0.0 109.85 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 46.3 t -115.58 140.81 48.82 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.859 0.864 . . . . 0.0 109.295 176.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 C-N-CA 123.354 0.661 . . . . 0.0 109.642 -179.017 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.548 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 110.807 -0.071 . . . . 0.0 110.807 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.6 ptt? -54.89 -50.51 68.58 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.489 0.716 . . . . 0.0 111.901 -177.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.594 HD23 ' H ' ' A' ' 24' ' ' LEU . 1.8 pt? -63.91 -36.13 82.93 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.633 1.173 . . . . 0.0 111.923 179.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.8 mm? -63.85 -45.66 88.53 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.246 0.618 . . . . 0.0 110.247 176.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -74.12 -37.23 64.15 Favored 'General case' 0 N--CA 1.484 1.247 0 O-C-N 124.064 0.853 . . . . 0.0 110.983 -172.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -59.98 -52.48 65.2 Favored 'General case' 0 C--N 1.356 0.852 0 O-C-N 124.008 0.817 . . . . 0.0 109.743 175.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 44' ' ' LEU . 13.2 tp -62.0 -45.22 94.58 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.338 1.024 . . . . 0.0 110.954 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 80.1 ttt180 -58.3 -39.31 78.99 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.994 0.918 . . . . 0.0 111.583 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.78 -50.78 61.57 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.596 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.0 pt -81.61 -19.77 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -171.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.531 HG21 HD12 ' A' ' 58' ' ' LEU . 80.6 p -99.35 -42.77 6.84 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.026 0.53 . . . . 0.0 110.556 178.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 99.12 -0.05 57.28 Favored Glycine 0 N--CA 1.469 0.849 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.329 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.713 HD12 HD13 ' A' ' 58' ' ' LEU . 95.4 mt -80.42 111.5 17.24 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 0 C-N-CA 123.852 0.861 . . . . 0.0 109.524 178.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -75.04 -34.77 61.9 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.783 0.833 . . . . 0.0 110.527 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -56.51 106.65 0.71 Allowed Pre-proline 0 N--CA 1.483 1.209 0 C-N-CA 124.457 1.103 . . . . 0.0 111.241 178.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.543 ' HA ' HD12 ' A' ' 40' ' ' LEU . 59.8 Cg_endo -68.45 -21.16 40.9 Favored 'Trans proline' 0 C--N 1.386 2.506 0 C-N-CA 122.897 2.398 . . . . 0.0 112.103 -175.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -66.69 -44.64 81.21 Favored 'General case' 0 C--N 1.349 0.579 0 C-N-CA 123.541 0.736 . . . . 0.0 110.862 177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.448 ' HB3' HG21 ' A' ' 34' ' ' ILE . 2.0 t80 -65.42 -31.37 72.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.285 -179.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 37' ' ' PRO . 47.4 mt -72.21 -42.82 65.32 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.649 177.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -60.36 -43.13 96.83 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.273 0.629 . . . . 0.0 110.908 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.551 ' HA ' ' HE3' ' A' ' 45' ' ' LYS . 44.3 mt-10 -63.09 -39.03 93.51 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 123.623 0.769 . . . . 0.0 111.471 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.42 ' HB2' HD21 ' A' ' 58' ' ' LEU . . . -65.79 -46.72 77.66 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.319 0.648 . . . . 0.0 111.506 174.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.558 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.5 mm? -66.82 -30.49 70.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.038 0.935 . . . . 0.0 110.753 -179.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.551 ' HE3' ' HA ' ' A' ' 42' ' ' GLU . 0.2 OUTLIER -75.1 -40.68 59.79 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.112 0.965 . . . . 0.0 110.108 179.018 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.57 -35.16 80.01 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.633 0.773 . . . . 0.0 110.365 176.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 m -91.12 -3.53 57.01 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 115.069 -0.968 . . . . 0.0 111.473 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 62.59 20.91 12.33 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.232 1.413 . . . . 0.0 112.607 175.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 120.93 -5.25 11.36 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 119.426 -0.652 . . . . 0.0 113.483 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -87.17 115.51 24.61 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 117.443 0.621 . . . . 0.0 111.012 -178.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.0 tp -66.0 -32.28 57.43 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.359 0 C-N-CA 123.916 0.886 . . . . 0.0 111.733 -178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.2 m -66.44 -47.44 73.18 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.088 0.955 . . . . 0.0 111.786 -178.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -69.13 -38.24 78.75 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 176.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -50.98 67.63 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 123.794 0.683 . . . . 0.0 111.893 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.2 p -67.53 -39.93 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.86 177.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.3 t -61.97 -31.3 71.63 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.174 0.59 . . . . 0.0 111.854 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.9 mt -83.17 -36.3 24.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.994 0.918 . . . . 0.0 111.518 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.713 HD13 HD12 ' A' ' 34' ' ' ILE . 53.2 mt -73.15 -29.15 62.67 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 111.557 0.206 . . . . 0.0 111.557 177.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.458 ' O ' HG23 ' A' ' 63' ' ' VAL . 46.2 p -77.97 -30.5 50.29 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 122.766 0.427 . . . . 0.0 110.063 173.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -57.65 -29.98 65.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.624 0.77 . . . . 0.0 111.54 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -53.94 -46.99 71.7 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.933 1.293 . . . . 0.0 111.726 175.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -90.94 -17.26 26.68 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.392 0.677 . . . . 0.0 111.605 -177.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 59' ' ' THR . 87.7 t -67.94 -32.12 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -61.98 98.26 0.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 123.539 0.736 . . . . 0.0 110.602 174.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.45 150.29 84.64 Favored Pre-proline 0 CA--C 1.56 1.337 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.975 174.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -77.77 133.65 31.2 Favored 'Cis proline' 0 C--N 1.381 2.279 0 CA-C-N 120.324 1.151 . . . . 0.0 113.188 2.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 59.8 p -92.6 130.34 38.26 Favored 'General case' 0 C--O 1.243 0.723 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 172.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.71 168.09 17.34 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 123.579 0.549 . . . . 0.0 111.43 179.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -78.61 107.44 11.28 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 178.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.4 p -68.5 107.65 2.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.249 177.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 30.3 m -65.16 152.91 8.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.852 0 C-N-CA 123.876 0.87 . . . . 0.0 111.721 178.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -108.08 102.97 12.09 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.784 0.834 . . . . 0.0 109.063 174.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 7.4 t -93.24 145.77 24.19 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.236 0.615 . . . . 0.0 110.983 -176.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.81 134.9 22.89 Favored Pre-proline 0 N--CA 1.478 0.957 0 C-N-CA 124.196 0.998 . . . . 0.0 109.771 -178.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -75.69 175.06 11.79 Favored 'Trans proline' 0 C--N 1.377 2.038 0 C-N-CA 122.894 2.396 . . . . 0.0 112.94 -178.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 34.0 p -65.25 111.26 2.9 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.256 1.022 . . . . 0.0 111.841 -175.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.07 -38.87 24.25 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.94 0.896 . . . . 0.0 111.415 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 60.5 t -75.92 94.54 1.06 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 C-N-CA 123.117 0.567 . . . . 0.0 109.818 -177.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.37 -178.98 6.52 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.491 0.716 . . . . 0.0 111.05 178.117 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -144.14 51.72 0.63 Allowed Glycine 0 C--N 1.338 0.672 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 45.3 t -101.01 122.58 43.79 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.281 1.033 . . . . 0.0 109.61 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -148.42 78.46 1.42 Allowed 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 177.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -112.9 98.99 7.53 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.958 0.903 . . . . 0.0 110.056 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -161.57 99.63 1.15 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.98 0.912 . . . . 0.0 108.75 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -135.37 107.97 7.43 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.435 0.694 . . . . 0.0 109.227 -179.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -140.94 122.33 14.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.73 0.812 . . . . 0.0 109.576 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 85.0 t -105.08 117.87 51.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 174.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.564 ' H ' HD23 ' A' ' 88' ' ' LEU . 1.0 OUTLIER -108.13 61.7 0.61 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 122.508 1.147 . . . . 0.0 108.935 178.598 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -125.52 148.22 48.96 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 114.221 -1.354 . . . . 0.0 108.912 178.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.503 ' HB2' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -160.02 159.93 32.65 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.092 0.472 . . . . 0.0 110.354 -174.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 5.4 t -121.26 36.78 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 168.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.503 HG12 ' HB2' ' A' ' 90' ' ' LYS . 39.9 mm -83.59 70.13 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -162.21 104.22 1.13 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.632 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.15 49.49 2.08 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.4 t -71.8 124.65 25.27 Favored 'General case' 0 C--N 1.352 0.713 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.202 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -164.93 144.09 6.82 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.773 0.829 . . . . 0.0 109.101 176.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -140.48 148.85 41.74 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.339 0.656 . . . . 0.0 109.573 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -111.88 126.32 54.98 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 101' ' ' ASP . 52.6 tptt -64.61 157.48 26.95 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.866 0.866 . . . . 0.0 110.312 179.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 61.6 m-20 -83.2 -16.87 44.84 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.022 0.529 . . . . 0.0 111.579 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . 0.416 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 3.3 m-20 -73.6 -49.36 26.62 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -170.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.22 -34.37 77.5 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.349 0.522 . . . . 0.0 110.65 176.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -61.74 -50.37 72.67 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.797 0.686 . . . . 0.0 109.98 176.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -69.19 -31.81 70.67 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.6 1.187 . . . . 0.0 111.651 -176.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -72.02 -46.57 56.61 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.599 0.76 . . . . 0.0 111.161 -178.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 46.9 mm -67.66 -39.3 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.419 0.687 . . . . 0.0 109.596 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.39 97.03 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.09 0.956 . . . . 0.0 111.43 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 7.3 tt -67.37 -40.64 85.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 0.0 109.239 178.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 48.4 t -65.55 -41.29 93.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.297 0.639 . . . . 0.0 111.419 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 39.8 tp -68.3 -52.54 32.42 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.256 0.622 . . . . 0.0 110.181 -177.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.19 -30.59 69.72 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.383 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 38.81 43.42 0.73 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.944 1.698 . . . . 0.0 112.293 -171.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.0 p -55.44 130.56 70.11 Favored Pre-proline 0 CA--C 1.546 0.802 0 CA-C-N 113.856 -1.52 . . . . 0.0 111.288 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.16 125.95 20.89 Favored 'Trans proline' 0 C--N 1.385 2.485 0 C-N-CA 123.108 2.539 . . . . 0.0 111.628 -178.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -86.81 44.58 1.18 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.815 0.846 . . . . 0.0 110.935 -175.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.537 HD11 ' HB2' ' A' ' 123' ' ' LEU . 48.2 mt -72.39 92.29 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.687 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 173.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -107.74 77.84 1.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 177.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . 0.404 ' O ' ' HG2' ' A' ' 121' ' ' ARG . . . 68.88 -72.37 0.1 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.486 1.514 . . . . 0.0 111.635 -176.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.66 -12.37 57.98 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.479 1.112 . . . . 0.0 113.286 -174.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -84.6 24.1 6.85 Favored Glycine 0 C--N 1.355 1.621 0 CA-C-O 119.531 -0.594 . . . . 0.0 114.011 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 118' ' ' ALA . 29.5 mmm180 -45.64 -23.14 0.21 Allowed 'General case' 0 N--CA 1.499 1.993 0 C-N-CA 126.335 1.854 . . . . 0.0 114.148 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -53.29 -40.38 64.68 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.189 1.396 . . . . 0.0 113.155 -176.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.537 ' HB2' HD11 ' A' ' 116' ' ' ILE . 65.5 mt -97.55 32.68 2.22 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.613 0.765 . . . . 0.0 111.347 -174.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -63.1 135.75 57.39 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.97 0.908 . . . . 0.0 110.382 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.8 tpm_? -74.73 99.46 3.72 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-O 121.379 0.609 . . . . 0.0 110.629 178.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 85.4 mtp -89.71 143.81 26.5 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 115.273 -0.876 . . . . 0.0 108.944 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -162.18 111.02 1.44 Allowed 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 -178.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 42.19 23.37 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 C-N-CA 125.966 1.706 . . . . 0.0 114.325 -170.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -116.22 78.48 1.2 Allowed 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.549 1.14 . . . . 0.0 107.994 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 47.3 p -63.07 -53.83 47.55 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.746 -177.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 57.4 p -83.84 116.47 22.76 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.082 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.965 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 . . . . . 0 CA--C 1.556 1.209 0 CA-C-O 120.779 0.323 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.0 ttt -55.2 -43.77 74.74 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.797 0.839 . . . . 0.0 112.64 -170.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.541 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.3 pt? -62.08 -38.25 88.14 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.541 HD22 ' HG ' ' A' ' 24' ' ' LEU . 3.5 mm? -65.58 -46.15 80.54 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 176.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 m-20 -64.45 -50.14 68.68 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.944 -174.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -47.28 71.14 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.52 1.128 . . . . 0.0 112.047 -177.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.562 HD11 HD12 ' A' ' 58' ' ' LEU . 2.3 tm? -68.34 -38.07 81.15 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.2 -177.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -65.54 -35.65 81.48 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.178 0.591 . . . . 0.0 110.941 172.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.64 -39.12 92.86 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.58 -179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.2 pt -96.41 -13.97 7.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.151 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -175.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.7 p -102.43 -51.83 3.25 Favored 'General case' 0 N--CA 1.5 2.039 0 CA-C-N 119.05 0.841 . . . . 0.0 110.89 173.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 103.75 7.22 42.31 Favored Glycine 0 N--CA 1.471 0.974 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.378 -175.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.657 HD12 HD13 ' A' ' 58' ' ' LEU . 60.6 mt -86.81 123.32 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 123.03 0.532 . . . . 0.0 110.891 -175.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -88.66 -11.63 44.74 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.98 0.912 . . . . 0.0 111.932 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.52 111.74 10.57 Favored Pre-proline 0 N--CA 1.48 1.034 0 CA-C-O 118.653 -0.689 . . . . 0.0 109.702 175.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.88 -36.92 81.31 Favored 'Trans proline' 0 C--N 1.382 2.335 0 C-N-CA 123.014 2.476 . . . . 0.0 112.256 -177.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.473 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 55.6 m -62.69 -48.9 77.3 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 118.676 -0.678 . . . . 0.0 110.577 -178.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -52.76 -40.67 63.36 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 124.232 1.013 . . . . 0.0 112.127 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HA ' HD12 ' A' ' 28' ' ' LEU . 27.6 mt -66.26 -47.87 72.32 Favored 'General case' 0 CA--C 1.548 0.87 0 O-C-N 124.2 0.938 . . . . 0.0 109.788 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -61.19 -42.09 97.96 Favored 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.218 175.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' A' ' 38' ' ' SER . 14.1 mm-40 -69.85 -32.98 71.66 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.356 1.063 . . . . 0.0 110.669 -174.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.87 -46.86 70.52 Favored 'General case' 0 C--N 1.347 0.477 0 O-C-N 123.975 0.797 . . . . 0.0 110.672 175.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.431 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.6 mm? -64.31 -34.81 78.99 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.878 0.871 . . . . 0.0 109.939 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 42' ' ' GLU . 4.1 tmmm? -69.98 -42.21 73.42 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.224 1.01 . . . . 0.0 110.244 178.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.63 -22.19 60.07 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.825 0.85 . . . . 0.0 111.358 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.0 m -104.38 5.2 34.19 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.287 0.635 . . . . 0.0 111.642 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 66.31 17.57 10.73 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.228 1.011 . . . . 0.0 111.529 174.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.49 -3.36 24.9 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.72 178.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -82.59 111.54 18.67 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.555 0.742 . . . . 0.0 110.087 -178.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.446 HG13 HD23 ' A' ' 28' ' ' LEU . 20.6 tt -74.33 -24.6 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 122.742 0.417 . . . . 0.0 111.915 -174.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.7 m -71.66 -44.81 63.63 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.587 0.755 . . . . 0.0 110.535 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.497 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 15.9 mm100 -71.45 -34.66 70.44 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.119 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.57 -51.72 68.34 Favored 'General case' 0 C--O 1.249 1.054 0 C-N-CA 123.646 0.778 . . . . 0.0 112.242 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 7.3 p -64.43 -39.28 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 122.581 0.352 . . . . 0.0 110.741 175.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.2 t -59.82 -31.38 69.68 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.012 0.525 . . . . 0.0 111.719 178.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 88.0 mt -78.92 -41.33 29.76 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.207 0.603 . . . . 0.0 111.552 178.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.657 HD13 HD12 ' A' ' 34' ' ' ILE . 74.1 mt -76.22 -21.06 56.86 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -178.02 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.415 ' O ' HG23 ' A' ' 63' ' ' VAL . 42.9 p -84.41 -2.6 57.42 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.879 0.472 . . . . 0.0 111.741 176.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.468 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 18.2 t70 -50.59 -28.64 9.1 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.657 1.183 . . . . 0.0 112.855 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -47.2 -49.37 23.02 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.504 1.122 . . . . 0.0 111.866 175.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -100.47 -8.3 23.31 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.981 0.913 . . . . 0.0 112.091 -177.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 59' ' ' THR . 86.7 t -74.06 -54.34 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 174.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 60' ' ' ASP . 25.0 pttm -72.74 101.61 3.14 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 122.044 0.926 . . . . 0.0 110.064 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 152.47 51.31 Favored Pre-proline 0 CA--C 1.564 1.486 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.445 177.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.04 112.07 2.16 Favored 'Cis proline' 0 C--N 1.383 2.347 0 CA-C-N 120.599 1.25 . . . . 0.0 111.61 -6.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.4 m -64.96 -55.22 20.43 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.646 -177.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -106.67 116.0 31.16 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -76.85 114.0 15.14 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 123.717 0.636 . . . . 0.0 109.613 178.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.5 t -99.61 170.7 8.4 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.523 0.729 . . . . 0.0 110.121 177.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 m -91.65 168.03 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.747 0.819 . . . . 0.0 110.349 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -140.74 110.34 6.37 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.232 0.613 . . . . 0.0 109.967 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.8 m -102.91 87.69 3.0 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 123.507 0.723 . . . . 0.0 109.597 -178.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -83.46 128.73 63.0 Favored Pre-proline 0 CA--C 1.553 1.066 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.226 179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -80.27 -165.61 0.35 Allowed 'Trans proline' 0 C--N 1.374 1.899 0 C-N-CA 123.063 2.509 . . . . 0.0 112.041 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.4 m -65.71 127.97 34.09 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 123.009 0.524 . . . . 0.0 111.325 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -101.01 -16.49 17.12 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.562 0.745 . . . . 0.0 110.949 -178.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.5 m -67.81 162.44 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 122.69 0.396 . . . . 0.0 111.371 176.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -79.8 162.98 24.78 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.084 0.953 . . . . 0.0 111.356 -177.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -154.2 29.39 0.71 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-N 115.666 -0.697 . . . . 0.0 112.721 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 88.0 p -150.69 -176.35 5.47 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.583 0.753 . . . . 0.0 110.645 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . 72.79 17.97 4.26 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.947 1.299 . . . . 0.0 110.81 -179.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.47 86.83 4.48 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 176.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -84.08 19.33 1.82 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 124.114 0.965 . . . . 0.0 112.656 -175.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 pttp 44.22 35.07 1.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 126.299 1.84 . . . . 0.0 113.587 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -122.07 102.47 8.17 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 124.017 0.927 . . . . 0.0 108.895 179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 34.3 t -82.74 127.43 39.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 177.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 57.8 tp -71.76 -36.71 70.48 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.092 0.557 . . . . 0.0 109.632 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.75 145.49 50.42 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.229 174.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.454 ' HD3' ' HB3' ' A' ' 93' ' ' ASP . 1.3 tpmt? -75.95 145.36 40.42 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-O 120.936 0.398 . . . . 0.0 110.625 -177.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 15.0 t -98.27 38.8 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 49.4 mt 56.11 77.42 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 125.03 1.332 . . . . 0.0 110.992 -172.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.454 ' HB3' ' HD3' ' A' ' 90' ' ' LYS . 33.0 t70 -111.09 89.55 3.08 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.234 175.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.8 pp -110.48 26.15 11.0 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.114 0.966 . . . . 0.0 109.751 171.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.3 m -58.6 92.86 0.02 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.857 1.263 . . . . 0.0 111.797 -175.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -136.47 86.11 2.19 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 176.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.04 141.22 58.84 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.121 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -68.92 117.4 10.55 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.732 0.813 . . . . 0.0 110.67 -174.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -92.27 148.54 22.06 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.347 0.659 . . . . 0.0 109.933 177.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -84.55 101.71 12.31 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.334 0.654 . . . . 0.0 109.588 -176.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -129.02 -68.88 0.73 Allowed 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 176.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -26.35 67.74 Favored 'General case' 0 C--N 1.349 0.565 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.225 -178.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -63.49 -55.53 23.3 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 176.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.43 -38.51 80.86 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.359 0.664 . . . . 0.0 111.751 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.82 -54.44 38.82 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.492 0.717 . . . . 0.0 111.807 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.16 -44.68 99.35 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.824 0.85 . . . . 0.0 110.583 -179.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 111' ' ' LEU . . . -62.25 -49.53 75.34 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.716 0.806 . . . . 0.0 111.497 -176.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.82 -39.65 83.88 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.927 0.891 . . . . 0.0 110.228 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.1 t -68.07 -44.95 75.17 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.736 0.415 . . . . 0.0 111.148 -177.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 83.3 mt -79.0 -15.74 57.85 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.049 0.54 . . . . 0.0 111.568 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 107' ' ' ALA . 1.9 tm? -74.47 -54.98 6.48 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 172.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -95.88 64.5 2.45 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.531 -176.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 50.3 m -98.57 153.15 38.08 Favored Pre-proline 0 CA--C 1.545 0.777 0 CA-C-N 115.239 -0.892 . . . . 0.0 110.311 176.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.16 125.81 14.11 Favored 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 122.344 2.029 . . . . 0.0 111.481 172.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -74.94 -27.89 60.37 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.935 0.494 . . . . 0.0 109.734 173.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 44.5 mm -54.47 104.37 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 123.861 0.865 . . . . 0.0 110.117 175.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.46 ' HG2' ' HA ' ' A' ' 122' ' ' ASP . 20.8 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.792 -175.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -117.42 -152.66 0.51 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.846 0.858 . . . . 0.0 109.869 178.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -65.41 -66.09 0.59 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.574 0.749 . . . . 0.0 111.766 179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -141.45 27.91 2.35 Favored Glycine 0 N--CA 1.474 1.218 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 -175.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -161.73 178.73 8.72 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.422 1.089 . . . . 0.0 109.035 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.46 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 22.3 m-20 -105.67 -64.58 1.13 Allowed 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 173.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 98.4 mt -103.79 160.57 14.67 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.176 0.59 . . . . 0.0 110.704 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -148.96 159.41 44.23 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.07 0.948 . . . . 0.0 109.648 177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -84.86 86.22 7.38 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 122.996 0.519 . . . . 0.0 110.445 -178.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 90.7 mtp -113.47 158.22 20.97 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.06 -0.973 . . . . 0.0 108.523 168.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 57.76 72.82 0.5 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 124.213 1.005 . . . . 0.0 111.167 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.59 7.58 2.34 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 114.467 -1.242 . . . . 0.0 109.656 179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -76.84 171.64 14.41 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.489 1.116 . . . . 0.0 111.774 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 4.7 t -145.89 145.53 30.75 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 123.136 0.574 . . . . 0.0 110.338 -177.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 37.1 t -94.21 104.67 16.67 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.13 0.972 . . . . 0.0 110.57 -176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.201 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.044 173.806 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.425 ' HG3' HD21 ' A' ' 26' ' ' ASN . 29.4 tp60 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 119.736 -0.173 . . . . 0.0 111.299 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -63.29 -40.73 98.18 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.024 0.53 . . . . 0.0 111.421 -171.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.495 HD12 ' HG ' ' A' ' 44' ' ' LEU . 2.1 pt? -64.78 -35.14 80.13 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.83 0.852 . . . . 0.0 111.623 177.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.09 -53.24 58.17 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 174.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.425 HD21 ' HG3' ' A' ' 22' ' ' GLN . 71.3 m-20 -64.67 -45.54 86.28 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.941 -173.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -61.4 -55.46 31.15 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.147 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.581 HD23 ' HA ' ' A' ' 40' ' ' LEU . 17.9 tp -59.76 -47.15 86.81 Favored 'General case' 0 C--N 1.36 1.057 0 O-C-N 123.472 0.482 . . . . 0.0 110.45 -179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -53.37 -40.23 64.81 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.694 1.198 . . . . 0.0 111.857 178.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -70.76 -46.64 62.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.047 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 pt -89.9 -0.67 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -171.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.525 HG21 HD12 ' A' ' 58' ' ' LEU . 74.2 p -108.31 -46.98 3.61 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.682 0.793 . . . . 0.0 109.574 170.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 106.43 -8.28 40.67 Favored Glycine 0 C--N 1.342 0.885 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.467 -177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 75.0 mt -80.47 117.23 26.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.115 0.966 . . . . 0.0 110.486 -176.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -83.48 -17.03 43.37 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.224 0.953 . . . . 0.0 111.22 -179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.72 108.8 2.41 Favored Pre-proline 0 N--CA 1.48 1.044 0 C-N-CA 124.116 0.966 . . . . 0.0 109.776 -179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -64.74 -30.31 59.35 Favored 'Trans proline' 0 C--N 1.379 2.136 0 C-N-CA 122.725 2.284 . . . . 0.0 112.517 -173.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.508 ' O ' ' HG2' ' A' ' 42' ' ' GLU . 57.3 m -58.48 -52.59 64.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.018 0.527 . . . . 0.0 110.433 178.237 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -51.68 -35.08 41.2 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.303 1.041 . . . . 0.0 112.046 178.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.581 ' HA ' HD23 ' A' ' 28' ' ' LEU . 44.5 mt -70.96 -45.98 63.18 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 123.802 0.689 . . . . 0.0 110.643 -177.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -66.48 -37.02 84.18 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.712 0.405 . . . . 0.0 111.379 177.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 38' ' ' SER . 18.5 mm-40 -64.22 -46.21 84.86 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.226 1.01 . . . . 0.0 110.765 179.383 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -41.1 96.69 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.63 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.495 ' HG ' HD12 ' A' ' 24' ' ' LEU . 3.3 mm? -69.74 -37.49 76.48 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.387 0.675 . . . . 0.0 111.524 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -74.26 -36.57 63.84 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.433 0.293 . . . . 0.0 110.521 -176.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.574 ' HA ' ' HG3' ' A' ' 75' ' ' PRO . . . -77.64 -22.02 51.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.242 0.617 . . . . 0.0 111.804 -177.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 89.6 p -94.96 3.13 55.3 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.234 0.614 . . . . 0.0 111.795 179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 75.92 -18.7 0.45 Allowed 'General case' 0 N--CA 1.496 1.851 0 C-N-CA 125.084 1.354 . . . . 0.0 112.004 -175.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 140.05 -7.16 2.91 Favored Glycine 0 C--N 1.343 0.929 0 N-CA-C 111.971 -0.452 . . . . 0.0 111.971 -172.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -78.23 107.27 10.72 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.038 0.535 . . . . 0.0 110.558 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.463 ' O ' HG23 ' A' ' 55' ' ' VAL . 13.3 tt -66.98 -26.63 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.199 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 11.5 m -67.03 -50.22 62.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.397 0.618 . . . . 0.0 110.207 177.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 16.5 mm100 -61.99 -36.06 80.36 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.612 176.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.57 -45.75 90.94 Favored 'General case' 0 C--O 1.248 0.982 0 C-N-CA 123.758 0.823 . . . . 0.0 111.7 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 51' ' ' ILE . 48.5 t -59.97 -45.48 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 173.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.7 t -58.71 -35.59 72.9 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.724 0.809 . . . . 0.0 111.756 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 96.3 mt -71.63 -40.03 70.03 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.31 0.644 . . . . 0.0 111.034 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.525 HD12 HG21 ' A' ' 32' ' ' THR . 51.9 mt -75.61 -25.15 56.71 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.5 p -84.28 -18.69 35.57 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 122.463 0.305 . . . . 0.0 110.441 174.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -68.87 -35.5 76.98 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.486 0.715 . . . . 0.0 109.596 174.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -52.69 -44.63 66.41 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.141 1.376 . . . . 0.0 113.576 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -80.81 -3.26 50.44 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.232 0.613 . . . . 0.0 112.281 -173.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.3 p -139.81 30.58 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.284 0 CA-C-O 122.429 1.109 . . . . 0.0 109.543 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 41.0 tttm -84.8 5.23 29.45 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.375 1.07 . . . . 0.0 112.475 -170.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -106.14 159.8 28.41 Favored Pre-proline 0 CA--C 1.562 1.418 0 C-N-CA 124.146 0.978 . . . . 0.0 110.481 178.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -78.81 -45.02 0.44 Allowed 'Cis proline' 0 C--N 1.384 2.402 0 CA-C-N 120.791 1.318 . . . . 0.0 112.542 -4.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.0 t -133.23 81.12 1.92 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 73.0 mm-40 -107.59 59.28 0.62 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -56.85 107.3 0.38 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.867 -168.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 82.8 p -95.88 -174.6 3.17 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.953 0.901 . . . . 0.0 109.885 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.2 t -76.07 95.09 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 168.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -73.81 -12.42 60.68 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.76 0.824 . . . . 0.0 112.315 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.7 t -94.33 159.48 15.1 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 171.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -87.13 148.88 46.11 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 123.032 0.533 . . . . 0.0 110.995 -176.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . 0.574 ' HG3' ' HA ' ' A' ' 46' ' ' ALA . 38.8 Cg_endo -65.31 128.94 21.47 Favored 'Trans proline' 0 C--N 1.379 2.157 0 C-N-CA 122.354 2.036 . . . . 0.0 109.599 167.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.9 p -69.73 82.83 0.45 Allowed 'General case' 0 CA--C 1.548 0.869 0 CA-C-O 121.703 0.763 . . . . 0.0 111.028 -176.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.412 ' HG3' HG13 ' A' ' 78' ' ' VAL . 12.8 pt-20 -68.8 -26.57 65.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.969 175.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.412 HG13 ' HG3' ' A' ' 77' ' ' GLU . 27.4 m -116.33 144.47 23.95 Favored 'Isoleucine or valine' 0 C--O 1.244 0.81 0 C-N-CA 124.392 1.077 . . . . 0.0 109.541 176.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -108.39 146.67 32.7 Favored 'General case' 0 C--O 1.242 0.662 0 C-N-CA 124.303 1.041 . . . . 0.0 108.924 177.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 81.01 42.3 9.67 Favored Glycine 0 C--N 1.343 0.949 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -173.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 64.2 p -67.07 109.21 2.92 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.742 0.817 . . . . 0.0 110.753 -178.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -85.9 62.62 7.57 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.672 0.789 . . . . 0.0 109.663 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -86.8 128.83 35.05 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.579 0.752 . . . . 0.0 109.291 177.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -63.97 100.62 0.32 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.835 0.854 . . . . 0.0 110.117 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.65 104.47 7.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 -177.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -97.51 164.22 12.53 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.434 0.694 . . . . 0.0 110.752 178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 58.9 t -89.45 106.78 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.9 tt -86.67 80.06 8.68 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 177.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -104.41 -168.39 1.48 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.95 0.9 . . . . 0.0 109.823 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -160.29 142.37 12.87 Favored 'General case' 0 N--CA 1.477 0.898 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 9.5 p -102.45 -9.18 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 123.153 0.581 . . . . 0.0 111.476 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 56.2 mt -72.79 -28.45 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.337 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.454 ' HB3' HG22 ' A' ' 95' ' ' THR . 8.9 m-20 -57.96 113.35 1.84 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.398 0.679 . . . . 0.0 110.141 172.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 1.3 pp -79.98 9.97 4.82 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.616 0.766 . . . . 0.0 112.021 -178.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.454 HG22 ' HB3' ' A' ' 93' ' ' ASP . 6.2 t -58.0 87.78 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.361 1.064 . . . . 0.0 112.926 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 35.1 p-80 179.23 150.62 0.31 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.945 1.698 . . . . 0.0 107.968 175.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -87.76 161.9 17.33 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.405 HD22 HD21 ' A' ' 102' ' ' LEU . 2.6 m-20 -74.52 155.65 37.72 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.988 0.515 . . . . 0.0 110.151 174.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.21 168.44 18.25 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.763 173.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -80.64 -15.03 57.6 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.101 0.56 . . . . 0.0 111.966 -176.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -63.46 -66.21 0.57 Allowed 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.613 0.765 . . . . 0.0 111.808 -173.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.405 HD21 HD22 ' A' ' 98' ' ' ASN . 0.0 OUTLIER -64.24 -29.35 70.45 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.979 0.512 . . . . 0.0 111.646 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -64.31 -52.71 57.18 Favored 'General case' 0 C--N 1.351 0.633 0 C-N-CA 123.091 0.556 . . . . 0.0 110.944 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.64 -30.23 68.89 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.323 0.649 . . . . 0.0 111.498 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.88 -54.69 30.83 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.714 0.806 . . . . 0.0 110.941 177.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 41.2 mm -70.76 -36.78 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.471 0.708 . . . . 0.0 110.773 -178.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.35 -38.91 92.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.828 0.851 . . . . 0.0 111.123 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 52.3 tp -70.94 -41.19 71.48 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 67.7 m -63.58 -29.58 70.82 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.851 0.46 . . . . 0.0 111.259 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 56.5 tp -74.62 -41.01 61.17 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.171 0.989 . . . . 0.0 109.874 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.6 tt -67.78 -39.84 84.02 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.892 0.877 . . . . 0.0 109.671 177.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -96.38 13.61 27.18 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.851 0.861 . . . . 0.0 110.981 -176.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.2 t -67.63 130.84 93.01 Favored Pre-proline 0 N--CA 1.474 0.748 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -62.26 145.92 95.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 122.772 2.315 . . . . 0.0 112.215 -174.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -83.57 70.18 10.23 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.145 0.974 . . . . 0.0 109.223 -177.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.404 HD12 ' HA ' ' A' ' 121' ' ' ARG . 47.9 mm -96.14 116.95 39.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.933 -177.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -93.11 45.4 1.17 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.191 0.996 . . . . 0.0 109.416 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.4 -170.69 0.85 Allowed 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.939 1.296 . . . . 0.0 110.249 -175.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -86.0 -21.27 27.89 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.561 0.744 . . . . 0.0 111.593 179.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -170.5 76.01 0.1 Allowed Glycine 0 C--N 1.351 1.386 0 N-CA-C 111.829 -0.508 . . . . 0.0 111.829 -177.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.404 ' HA ' HD12 ' A' ' 116' ' ' ILE . 0.1 OUTLIER 64.02 153.64 0.05 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 125.545 1.538 . . . . 0.0 112.377 -173.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -165.7 -69.2 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.312 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 52.9 tp -74.59 107.8 6.94 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.772 -177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -139.19 133.46 31.44 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 174.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -122.97 78.05 1.51 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.301 0.64 . . . . 0.0 109.642 -178.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 60.7 mtm 46.43 98.42 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 125.757 1.623 . . . . 0.0 114.696 164.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -56.77 -36.73 70.17 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.228 0.611 . . . . 0.0 110.343 174.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -72.82 93.5 1.69 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.086 170.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.15 114.32 15.84 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 175.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.3 p -71.57 128.25 35.22 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.009 0.524 . . . . 0.0 109.997 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 27.1 p -70.33 85.09 0.58 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.741 0.816 . . . . 0.0 110.088 176.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 C-N-CA 124.242 1.017 . . . . 0.0 108.707 -176.585 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 . . . . . 0 CA--C 1.555 1.138 0 N-CA-C 110.521 -0.177 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -36.38 76.34 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.677 0.791 . . . . 0.0 112.182 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.521 ' HG ' HD22 ' A' ' 25' ' ' LEU . 2.4 pt? -66.26 -39.43 89.46 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.589 0.756 . . . . 0.0 111.12 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.521 HD22 ' HG ' ' A' ' 24' ' ' LEU . 4.3 mm? -66.98 -46.94 73.07 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.12 0.568 . . . . 0.0 110.188 177.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -62.16 -52.05 65.4 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.64 1.213 . . . . 0.0 110.968 -176.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -58.42 -53.7 55.4 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.204 0.94 . . . . 0.0 111.043 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.442 HD12 HD22 ' A' ' 40' ' ' LEU . 2.1 tm? -56.24 -50.75 70.41 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.259 0.974 . . . . 0.0 110.027 -177.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.436 ' HB2' HD13 ' A' ' 40' ' ' LEU . 72.4 ttt180 -61.14 -33.73 73.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.117 0.967 . . . . 0.0 111.952 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -74.12 -40.41 62.69 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.568 0.747 . . . . 0.0 110.723 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.2 pt -95.18 -15.5 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 CA-C-N 115.668 -0.696 . . . . 0.0 112.589 -169.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.402 HG22 HG13 ' A' ' 55' ' ' VAL . 72.9 p -96.36 -43.13 7.8 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 170.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 97.95 -4.69 61.18 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.868 -177.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.495 HD12 HD13 ' A' ' 58' ' ' LEU . 62.5 mt -75.3 120.36 24.81 Favored 'Isoleucine or valine' 0 C--N 1.354 0.774 0 C-N-CA 123.756 0.822 . . . . 0.0 109.443 -179.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -86.43 -17.55 34.01 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.57 0.748 . . . . 0.0 111.353 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -70.16 109.48 4.93 Favored Pre-proline 0 N--CA 1.483 1.18 0 C-N-CA 123.544 0.738 . . . . 0.0 110.205 -178.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.6 -25.46 79.3 Favored 'Trans proline' 0 C--N 1.388 2.637 0 C-N-CA 123.217 2.611 . . . . 0.0 113.255 -175.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 50.4 m -58.36 -51.74 68.54 Favored 'General case' 0 N--CA 1.478 0.935 0 O-C-N 123.662 0.601 . . . . 0.0 110.555 177.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -61.15 -36.46 79.85 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.733 0.813 . . . . 0.0 111.423 -178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.442 HD22 HD12 ' A' ' 28' ' ' LEU . 13.9 mt -68.2 -56.67 7.88 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 124.386 1.054 . . . . 0.0 109.521 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -59.86 -50.19 74.75 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.117 178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -56.68 -40.21 75.15 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.568 0.747 . . . . 0.0 111.903 -176.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.4 -42.8 87.3 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 123.739 0.65 . . . . 0.0 110.873 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.428 HD23 ' O ' ' A' ' 40' ' ' LEU . 4.3 mm? -69.35 -23.53 63.78 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.825 0.85 . . . . 0.0 111.888 177.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -77.73 -47.94 17.87 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 177.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.98 -37.31 86.64 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 124.228 0.955 . . . . 0.0 110.943 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 32.9 m -89.58 -3.29 58.37 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 123.778 0.831 . . . . 0.0 111.908 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.453 HD22 ' N ' ' A' ' 48' ' ' ASN . 0.8 OUTLIER 64.2 21.94 12.7 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.69 1.196 . . . . 0.0 112.47 176.256 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.26 -8.56 24.79 Favored Glycine 0 C--N 1.349 1.289 0 CA-C-O 119.675 -0.514 . . . . 0.0 113.218 178.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.06 111.86 13.09 Favored 'General case' 0 C--O 1.246 0.918 0 CA-C-N 117.329 0.564 . . . . 0.0 110.519 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.469 ' O ' HG23 ' A' ' 55' ' ' VAL . 5.7 tp -65.98 -34.46 70.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 C-N-CA 123.268 0.627 . . . . 0.0 111.351 -173.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 35.7 m -66.65 -49.97 64.47 Favored 'General case' 0 C--O 1.246 0.869 0 C-N-CA 123.823 0.849 . . . . 0.0 110.866 -173.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -64.28 -39.94 94.96 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.259 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -53.88 -52.89 59.05 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.071 0.857 . . . . 0.0 112.317 178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 51' ' ' ILE . 40.9 t -63.73 -44.0 98.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 122.973 0.509 . . . . 0.0 110.433 179.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.8 t -58.5 -43.67 89.15 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 124.261 0.976 . . . . 0.0 111.187 -177.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.16 -30.23 62.16 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.957 -176.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.495 HD13 HD12 ' A' ' 34' ' ' ILE . 72.8 mt -72.33 -40.71 67.21 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 174.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 71.6 p -80.94 -11.19 59.62 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.868 0.467 . . . . 0.0 111.62 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.99 -21.87 61.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.768 0.827 . . . . 0.0 112.393 -178.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -57.56 -37.96 74.0 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.756 0.822 . . . . 0.0 112.672 -177.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.1 ptt85 -87.61 -19.68 27.44 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.821 0.848 . . . . 0.0 110.71 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 95.0 t -79.38 -30.49 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.493 0.717 . . . . 0.0 109.145 177.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -66.59 102.63 0.93 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.132 178.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.501 ' HA ' ' N ' ' A' ' 67' ' ' SER . 44.0 mt-10 -65.4 150.82 95.34 Favored Pre-proline 0 CA--C 1.554 1.107 0 C-N-CA 123.833 0.853 . . . . 0.0 111.914 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.11 109.1 0.86 Allowed 'Cis proline' 0 C--N 1.389 2.702 0 CA-C-N 120.255 1.127 . . . . 0.0 113.454 5.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.501 ' N ' ' HA ' ' A' ' 65' ' ' GLU . 49.6 m -76.97 108.13 9.8 Favored 'General case' 0 C--N 1.351 0.641 0 C-N-CA 123.953 0.901 . . . . 0.0 109.758 -179.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -152.23 148.67 27.84 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.604 1.161 . . . . 0.0 108.477 177.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 58.83 26.49 14.88 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.11 0.964 . . . . 0.0 110.674 -177.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 48.5 p -74.34 104.8 5.23 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 123.984 0.914 . . . . 0.0 110.637 -172.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 19.5 m -59.86 141.09 17.02 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.762 0.825 . . . . 0.0 111.044 177.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 89.93 0.29 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.876 0.87 . . . . 0.0 110.527 -177.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.1 m -124.64 54.1 1.41 Allowed 'General case' 0 C--O 1.245 0.831 0 C-N-CA 124.363 1.065 . . . . 0.0 108.338 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -100.78 144.77 29.17 Favored Pre-proline 0 CA--C 1.545 0.78 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.264 -175.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -75.87 179.58 6.14 Favored 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.417 2.078 . . . . 0.0 111.348 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -80.03 70.67 6.66 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 174.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -83.58 82.46 8.29 Favored 'General case' 0 C--N 1.348 0.538 0 CA-C-O 121.799 0.809 . . . . 0.0 109.109 -175.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.7 m -93.13 176.32 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.746 -178.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -73.45 109.82 7.26 Favored 'General case' 0 C--O 1.243 0.737 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -67.26 87.11 0.14 Allowed Glycine 0 C--N 1.348 1.198 0 CA-C-N 115.71 -0.677 . . . . 0.0 112.101 -178.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 13.7 t -59.33 93.98 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.095 0.958 . . . . 0.0 110.663 -178.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.68 74.92 7.49 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.286 1.035 . . . . 0.0 109.777 -174.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -58.73 141.14 53.67 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.872 174.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 p-10 -61.94 -18.99 62.22 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.259 1.024 . . . . 0.0 112.798 -175.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.1 tppt? -91.81 73.52 5.74 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-O 121.751 0.786 . . . . 0.0 109.824 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -133.76 112.73 11.61 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.999 -1.001 . . . . 0.0 108.976 173.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.22 120.43 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -79.46 -30.37 42.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.793 0.437 . . . . 0.0 110.493 -178.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.23 127.05 31.52 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 123.349 0.66 . . . . 0.0 110.379 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -77.19 135.57 38.51 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.929 0.492 . . . . 0.0 111.03 -172.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.2 t -109.7 28.16 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.124 0 CA-C-O 122.384 1.088 . . . . 0.0 109.071 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 14.0 mt -113.94 30.99 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 176.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -67.53 101.72 1.04 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.373 -1.285 . . . . 0.0 111.037 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.409 HD13 ' H ' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -103.02 -16.26 15.85 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.508 0.723 . . . . 0.0 110.718 177.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.1 p -81.56 69.5 8.23 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.044 0.938 . . . . 0.0 111.407 -176.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -92.61 -59.58 2.03 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.551 -178.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -96.05 43.85 1.08 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 122.47 1.129 . . . . 0.0 109.009 176.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -126.43 120.8 30.69 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 65.9 tttm -70.28 156.26 39.51 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.359 0.664 . . . . 0.0 109.722 174.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -77.96 73.84 4.52 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-O 121.716 0.769 . . . . 0.0 109.016 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -140.93 -72.1 0.35 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.571 -1.195 . . . . 0.0 108.323 -175.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -32.1 73.42 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.225 0.61 . . . . 0.0 110.365 175.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -62.82 -56.92 13.15 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.794 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.75 -33.31 75.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 124.095 0.872 . . . . 0.0 111.421 -176.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.05 -59.62 4.24 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.427 0.691 . . . . 0.0 111.517 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.6 mm -68.46 -41.19 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 123.468 0.707 . . . . 0.0 110.776 -176.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -65.82 -42.55 90.47 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.258 0.623 . . . . 0.0 111.799 -178.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 5.1 tt -69.34 -40.91 77.27 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 30.6 t -62.55 -43.89 97.69 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.502 0.721 . . . . 0.0 111.332 179.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.59 -47.78 45.11 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.788 0.835 . . . . 0.0 109.786 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 38.8 tp -71.83 -17.98 62.11 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.644 0.778 . . . . 0.0 110.926 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 47.29 36.22 4.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 126.379 1.871 . . . . 0.0 111.879 -177.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -143.84 139.57 16.27 Favored Pre-proline 0 C--O 1.24 0.596 0 CA-C-N 114.189 -1.369 . . . . 0.0 108.713 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -51.4 162.1 1.56 Allowed 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 123.592 2.861 . . . . 0.0 114.359 177.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.5 OUTLIER -67.66 -19.25 65.17 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.374 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 6.5 mt -96.07 139.36 19.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.91 0.884 . . . . 0.0 109.395 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -101.3 -55.32 2.57 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 161.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.98 -57.81 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 114.372 -1.285 . . . . 0.0 108.668 172.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -65.57 -16.35 63.62 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 114.305 -1.316 . . . . 0.0 113.03 -175.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -66.93 -28.87 73.96 Favored Glycine 0 C--N 1.355 1.631 0 C-N-CA 123.1 0.381 . . . . 0.0 113.238 -178.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 59.76 23.68 12.59 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.573 1.149 . . . . 0.0 112.424 176.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -90.18 46.22 1.33 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.195 0.998 . . . . 0.0 109.698 -174.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.97 98.27 0.94 Allowed 'General case' 0 C--N 1.355 0.806 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.093 -176.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -165.29 124.67 1.77 Allowed 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -148.63 29.79 0.83 Allowed 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 18.1 mmt -92.14 158.26 16.28 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.557 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -71.77 143.13 49.67 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 122.696 0.398 . . . . 0.0 110.292 174.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -21.98 64.69 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.969 0.508 . . . . 0.0 111.049 173.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -84.44 116.86 23.3 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.006 169.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 60.7 m -67.99 -41.58 82.08 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.535 0.734 . . . . 0.0 110.268 176.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 54.6 p -79.79 125.78 30.12 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.162 174.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.002 0 C-N-CA 123.492 0.717 . . . . 0.0 109.913 178.126 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 120.914 0.388 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -56.61 -32.72 65.56 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.358 1.063 . . . . 0.0 113.136 -173.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -61.08 -46.44 90.62 Favored 'General case' 0 C--O 1.253 1.252 0 C-N-CA 123.067 0.547 . . . . 0.0 111.072 -178.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.522 HD22 ' HB2' ' A' ' 40' ' ' LEU . 44.3 mt -74.32 -42.58 59.23 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.817 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.4 m-20 -62.92 -42.48 99.81 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.056 0.847 . . . . 0.0 111.247 -178.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.47 ' O ' HG12 ' A' ' 31' ' ' ILE . 13.5 mm100 -63.26 -57.99 8.63 Favored 'General case' 0 C--N 1.356 0.851 0 CA-C-O 118.681 -0.676 . . . . 0.0 110.188 178.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.459 ' HB3' HD22 ' A' ' 40' ' ' LEU . 16.8 mt -51.49 -53.23 39.53 Favored 'General case' 0 C--N 1.374 1.634 0 O-C-N 123.979 0.799 . . . . 0.0 111.387 176.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.3 ttt180 -53.14 -38.66 62.9 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.567 1.147 . . . . 0.0 112.162 -175.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.49 -51.66 33.8 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 123.287 0.635 . . . . 0.0 110.846 177.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.47 HG12 ' O ' ' A' ' 27' ' ' GLN . 4.6 pt -91.28 4.03 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -172.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.464 HG21 HD12 ' A' ' 58' ' ' LEU . 45.3 p -122.1 -38.62 2.68 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.432 0.693 . . . . 0.0 110.344 175.283 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.94 -1.68 63.42 Favored Glycine 0 N--CA 1.475 1.287 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.488 178.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.44 ' HB ' HD21 ' A' ' 40' ' ' LEU . 86.0 mt -79.73 117.31 25.26 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 123.77 0.828 . . . . 0.0 109.922 -178.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -81.97 -18.6 42.9 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.739 0.649 . . . . 0.0 110.694 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 5.5 m-20 -68.77 104.88 0.81 Allowed Pre-proline 0 N--CA 1.481 1.076 0 C-N-CA 123.991 0.916 . . . . 0.0 109.747 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.71 -25.31 34.0 Favored 'Trans proline' 0 C--N 1.377 2.039 0 C-N-CA 122.648 2.232 . . . . 0.0 111.799 -174.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.422 ' O ' ' HG3' ' A' ' 42' ' ' GLU . 42.8 m -66.61 -42.58 86.61 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.909 0.884 . . . . 0.0 110.806 177.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -66.08 -38.67 88.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.874 0.87 . . . . 0.0 109.821 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.522 ' HB2' HD22 ' A' ' 25' ' ' LEU . 56.5 mt -64.58 -41.42 96.27 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.604 175.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -62.5 -44.67 95.82 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 176.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 38' ' ' SER . 52.4 mt-10 -61.16 -37.87 84.44 Favored 'General case' 0 N--CA 1.481 1.077 0 O-C-N 123.587 0.555 . . . . 0.0 111.339 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.39 -48.15 62.04 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.786 0.679 . . . . 0.0 110.994 179.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -57.38 -40.62 78.55 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.397 1.079 . . . . 0.0 110.35 179.284 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 19.9 mtpp -75.66 -37.04 59.93 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.295 1.038 . . . . 0.0 111.722 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -15.75 62.88 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.686 0.394 . . . . 0.0 111.547 178.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -106.94 11.27 30.06 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.853 0.861 . . . . 0.0 110.982 177.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 65.82 15.79 10.2 Favored 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.489 1.116 . . . . 0.0 112.827 175.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.15 -0.34 28.31 Favored Glycine 0 C--N 1.341 0.83 0 C-N-CA 123.36 0.505 . . . . 0.0 112.343 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -83.55 110.4 18.19 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 123.182 0.593 . . . . 0.0 111.078 -179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.58 ' O ' HG23 ' A' ' 55' ' ' VAL . 8.1 tp -56.34 -38.71 56.62 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.707 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -58.43 -60.02 4.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.75 1.22 . . . . 0.0 112.279 -173.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.435 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 mm100 -66.93 -28.57 68.4 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.286 178.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -59.48 -44.42 93.05 Favored 'General case' 0 C--O 1.251 1.148 0 O-C-N 123.34 0.4 . . . . 0.0 111.019 174.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.58 HG23 ' O ' ' A' ' 51' ' ' ILE . 20.5 t -60.09 -46.99 93.66 Favored 'Isoleucine or valine' 0 C--N 1.362 1.131 0 O-C-N 123.762 0.664 . . . . 0.0 109.306 175.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.3 t -53.65 -50.41 65.82 Favored 'General case' 0 C--N 1.354 0.8 0 O-C-N 124.609 1.193 . . . . 0.0 111.683 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' GLN . 89.3 mt -60.47 -44.13 96.22 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.689 0.618 . . . . 0.0 111.336 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.464 HD12 HG21 ' A' ' 32' ' ' THR . 71.6 mt -73.26 -30.88 63.74 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.427 ' O ' HG12 ' A' ' 63' ' ' VAL . 42.9 p -78.0 -26.64 48.69 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.9 -0.407 . . . . 0.0 109.9 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -77.57 -13.01 60.02 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.98 0.512 . . . . 0.0 111.0 176.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.36 51.82 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 122.793 0.437 . . . . 0.0 110.95 174.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.5 ptp180 -70.6 -38.17 73.97 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 59' ' ' THR . 13.3 p -112.26 49.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 CA-C-O 122.731 1.253 . . . . 0.0 108.803 179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.7 tttt -75.61 92.66 2.96 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.09 -176.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.15 133.34 94.64 Favored Pre-proline 0 CA--C 1.559 1.318 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.569 -177.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -86.96 142.43 25.44 Favored 'Cis proline' 0 C--N 1.378 2.086 0 C-N-CA 124.708 -0.955 . . . . 0.0 112.433 -5.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.2 m -108.63 28.42 8.41 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.217 0.607 . . . . 0.0 110.144 176.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 65.38 13.36 8.77 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.27 1.428 . . . . 0.0 112.559 -176.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -107.5 -159.23 0.68 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.53 0.732 . . . . 0.0 109.81 -175.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 71.7 p -95.97 35.71 1.38 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.066 0.547 . . . . 0.0 112.389 -174.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.1 m -73.05 97.86 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 CA-C-O 121.033 0.444 . . . . 0.0 110.043 173.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -78.45 74.72 4.98 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 9.8 t -88.35 150.67 23.08 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.564 -177.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -95.84 150.29 37.16 Favored Pre-proline 0 C--O 1.243 0.734 0 C-N-CA 124.401 1.08 . . . . 0.0 109.219 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.25 115.3 4.1 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.071 1.847 . . . . 0.0 109.749 174.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.0 t -51.41 117.92 2.95 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.751 0.82 . . . . 0.0 110.795 -176.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -72.46 83.25 1.09 Allowed 'General case' 0 C--N 1.358 0.958 0 CA-C-O 121.869 0.842 . . . . 0.0 110.43 -173.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.0 p -163.96 112.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.691 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.305 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -74.13 90.04 2.01 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.301 0.572 . . . . 0.0 109.823 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.96 51.59 3.19 Favored Glycine 0 C--N 1.348 1.2 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.688 177.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.9 m -147.81 127.04 12.97 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.111 0.965 . . . . 0.0 109.474 -176.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -150.84 6.91 0.53 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.792 0.837 . . . . 0.0 111.097 176.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -78.44 99.72 6.54 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.341 0.656 . . . . 0.0 110.184 -178.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -72.82 142.35 48.02 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.586 0.754 . . . . 0.0 110.238 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -142.99 107.47 4.8 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.34 0.656 . . . . 0.0 109.611 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.51 126.57 26.11 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.476 0.711 . . . . 0.0 110.014 179.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.469 HG12 ' H ' ' A' ' 89' ' ' ALA . 43.2 t -77.7 125.11 37.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 77.6 mt -88.4 11.29 17.28 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.308 0.643 . . . . 0.0 112.125 -174.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.469 ' H ' HG12 ' A' ' 87' ' ' VAL . . . -83.76 -177.64 6.76 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.792 0.837 . . . . 0.0 110.638 174.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.456 ' HE3' ' N ' ' A' ' 90' ' ' LYS . 0.0 OUTLIER -164.06 155.92 16.62 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.877 0.871 . . . . 0.0 109.985 179.806 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.4 m -109.89 33.87 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.365 1.066 . . . . 0.0 110.443 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 60.4 mt -86.85 76.22 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.178 0.99 . . . . 0.0 109.125 -175.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -93.94 133.61 37.2 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.553 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.87 -5.86 5.65 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.24 1.016 . . . . 0.0 111.106 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.8 p -76.91 106.21 8.45 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.309 0.643 . . . . 0.0 110.664 -176.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -115.57 132.22 56.69 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 169.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -80.93 168.91 18.2 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.148 0.579 . . . . 0.0 111.855 -175.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -77.76 148.56 34.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.797 177.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.6 tptt -119.41 157.92 27.25 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -65.46 0.33 1.58 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.946 1.698 . . . . 0.0 114.366 -171.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -56.78 -67.44 0.31 Allowed 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 118.594 0.634 . . . . 0.0 111.301 -176.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.23 -23.23 41.01 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.693 -177.033 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -59.64 -55.83 29.45 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -70.64 -31.44 68.37 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.337 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -59.09 -56.53 21.07 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.861 0.464 . . . . 0.0 111.134 177.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.3 mm -67.47 -43.35 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.011 0.524 . . . . 0.0 110.776 -179.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.67 68.6 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.916 0.887 . . . . 0.0 111.639 -178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 95.6 mt -69.88 -41.19 75.12 Favored 'General case' 0 C--N 1.351 0.646 0 O-C-N 123.758 0.661 . . . . 0.0 111.331 -177.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.8 m -64.61 -31.02 72.05 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 123.369 0.418 . . . . 0.0 111.459 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.14 -33.43 33.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 123.821 0.848 . . . . 0.0 109.672 177.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.0 tp -74.21 -36.29 63.95 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.343 1.057 . . . . 0.0 111.34 -177.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -88.52 -176.38 5.28 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 121.763 0.792 . . . . 0.0 110.904 -175.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.2 m -130.72 100.33 17.81 Favored Pre-proline 0 C--O 1.244 0.79 0 N-CA-C 104.935 -2.246 . . . . 0.0 104.935 171.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' PRO . . . . . 0.469 ' HG2' HE21 ' A' ' 117' ' ' GLN . 5.0 Cg_endo -45.6 146.5 3.51 Favored 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 124.137 3.224 . . . . 0.0 113.514 -172.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -24.46 7.77 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.666 1.187 . . . . 0.0 113.371 -170.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.44 HG22 ' H ' ' A' ' 117' ' ' GLN . 3.5 mt -78.34 -147.26 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.866 0 C-N-CA 124.476 1.111 . . . . 0.0 108.179 177.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.469 HE21 ' HG2' ' A' ' 114' ' ' PRO . 68.3 mt-30 65.34 -70.28 0.09 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.255 1.422 . . . . 0.0 111.791 -173.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -109.72 -69.21 0.87 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 123.868 0.867 . . . . 0.0 111.322 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -90.78 19.57 5.4 Favored 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 123.911 0.884 . . . . 0.0 113.108 -166.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -129.49 -67.67 0.11 Allowed Glycine 0 C--N 1.348 1.197 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 -179.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 14.0 mmm180 54.5 75.62 0.28 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.693 1.197 . . . . 0.0 110.682 179.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -151.11 103.09 3.0 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 123.992 0.917 . . . . 0.0 109.004 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 95.4 mt -129.28 58.65 1.61 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.253 1.021 . . . . 0.0 108.547 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -66.06 92.99 0.18 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.103 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -132.39 -49.15 0.91 Allowed 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 -177.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.91 100.66 8.99 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 113.983 -1.462 . . . . 0.0 108.714 171.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -88.76 145.11 25.81 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.682 -0.636 . . . . 0.0 110.141 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -91.97 147.4 22.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.01 0.524 . . . . 0.0 110.077 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 62.98 26.83 15.69 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.916 1.286 . . . . 0.0 112.154 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -69.96 105.02 2.69 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.409 0.684 . . . . 0.0 110.737 -177.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.0 t -142.77 -173.27 3.84 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.263 1.025 . . . . 0.0 108.471 177.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.632 0 C-N-CA 123.413 0.685 . . . . 0.0 110.624 -177.201 . . . . . . . . 0 0 . 1 stop_ save_