data_2mch_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 2mch _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 ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.56 153.86 21.72 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.1 mt -125.62 149.31 48.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.405 1.482 . . . . 0.0 112.06 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.85 142.01 53.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.878 0.871 . . . . 0.0 110.557 164.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.88 -8.47 15.96 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.14 161.85 40.04 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.29 1.036 . . . . 0.0 113.548 -173.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.05 -164.82 49.66 Favored Glycine 0 CA--C 1.542 1.75 0 C-N-CA 124.3 0.952 . . . . 0.0 114.378 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.78 -24.32 71.05 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.582 2.855 . . . . 0.0 113.85 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.43 -8.09 59.63 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.907 1.683 . . . . 0.0 113.861 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.47 125.67 16.99 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.654 1.116 . . . . 0.0 111.971 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.64 -1.25 78.43 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 116.189 1.236 . . . . 0.0 116.189 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.2 mt -107.37 153.9 40.95 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.02 1.41 . . . . 0.0 112.292 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -55.6 143.15 80.23 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.231 3.287 . . . . 0.0 113.193 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -79.45 -33.39 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 122.412 0.285 . . . . 0.0 111.002 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -133.31 165.36 25.0 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.3 mtt85 -52.78 -42.19 64.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.842 1.257 . . . . 0.0 111.397 170.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.4 m -71.52 -36.76 71.15 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.838 0.855 . . . . 0.0 113.116 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -61.62 -43.94 97.92 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.917 1.235 . . . . 0.0 110.502 171.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.42 -47.61 83.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.318 0.647 . . . . 0.0 112.447 178.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -55.18 -46.47 75.8 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.096 1.358 . . . . 0.0 111.845 174.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.0 t -77.29 -31.49 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 118.404 -0.808 . . . . 0.0 112.27 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.1 mt -63.43 -43.57 97.05 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.491 1.496 . . . . 0.0 111.444 169.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.9 mt -63.43 -42.2 95.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 118.257 0.48 . . . . 0.0 110.552 174.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -60.27 -49.23 78.43 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.539 0.609 . . . . 0.0 112.619 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.83 -46.19 91.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.96 0.904 . . . . 0.0 110.676 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -59.57 -52.19 66.61 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.633 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.412 ' CH2' ' HE2' ' A' ' 91' ' ' LYS . 66.1 t90 -52.99 -43.42 66.42 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.814 1.188 . . . . 0.0 112.359 175.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -68.21 -43.32 78.28 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.226 0.921 . . . . 0.0 111.835 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -63.9 -46.62 84.03 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.337 -0.852 . . . . 0.0 112.079 174.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -56.72 -48.29 78.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.521 0.728 . . . . 0.0 110.306 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.412 ' HE2' ' CH2' ' A' ' 87' ' ' TRP . 1.2 tmmt? -56.08 -39.42 72.07 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.493 1.517 . . . . 0.0 112.501 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 mtpt -66.03 -37.6 86.3 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.888 1.222 . . . . 0.0 112.728 172.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.3 m -74.57 -39.29 62.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -153.59 104.97 2.53 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 128.387 2.675 . . . . 0.0 109.297 -170.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.53 -14.21 20.1 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.613 2.875 . . . . 0.0 116.506 -160.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.3 p-90 -66.76 -22.43 66.04 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -172.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -63.38 141.4 58.78 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.739 0.7 . . . . 0.0 112.428 -166.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -95.93 141.59 29.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.661 1.184 . . . . 0.0 111.536 174.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.41 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -91.44 117.48 29.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.752 1.221 . . . . 0.0 109.234 176.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -133.93 118.1 17.51 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.473 1.109 . . . . 0.0 111.559 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.41 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.58 57.13 0.81 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.61 1.195 . . . . 0.0 112.454 -177.577 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 98.7 p -63.11 159.15 17.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.318 162.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -52.86 -39.9 62.96 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.133 -0.98 . . . . 0.0 111.381 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.97 -40.78 96.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.329 1.052 . . . . 0.0 112.77 173.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -38.76 85.94 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.887 1.221 . . . . 0.0 111.935 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.04 -47.16 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 118.854 -0.594 . . . . 0.0 110.257 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -71.73 -27.06 62.74 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.102 0.864 . . . . 0.0 112.959 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -71.48 -40.0 70.54 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.396 1.078 . . . . 0.0 112.727 172.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -74.85 -38.44 61.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -132.86 80.8 59.96 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.959 1.704 . . . . 0.0 110.231 -168.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.37 -12.54 35.21 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.24 2.627 . . . . 0.0 114.746 -168.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -78.23 -8.65 58.6 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -78.02 -36.79 48.29 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.437 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 126.587 1.955 . . . . 0.0 115.084 170.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.8 153.55 25.2 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.413 1.485 . . . . 0.0 113.916 174.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.3 mt -121.33 149.92 42.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.36 1.464 . . . . 0.0 111.512 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -67.66 140.33 56.81 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.335 0.654 . . . . 0.0 110.123 162.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.16 -17.28 15.43 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.26 159.92 41.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.661 1.184 . . . . 0.0 112.835 -170.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.82 -164.26 53.36 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.354 0.978 . . . . 0.0 114.51 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.94 -24.15 75.28 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.555 2.837 . . . . 0.0 113.949 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.89 -6.78 59.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.723 1.609 . . . . 0.0 113.553 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.43 125.54 16.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.774 1.17 . . . . 0.0 112.104 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.88 -1.34 77.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 116.126 1.21 . . . . 0.0 116.126 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.3 mt -107.34 152.82 41.39 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 119.116 1.458 . . . . 0.0 112.289 -174.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -58.19 144.33 95.59 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 124.326 3.35 . . . . 0.0 112.874 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.0 t -79.48 -36.19 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 121.91 -0.493 . . . . 0.0 111.354 177.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -141.58 168.5 19.62 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.519 1.527 . . . . 0.0 112.874 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.9 -36.09 64.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.121 1.368 . . . . 0.0 111.99 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -60.31 -40.18 89.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.731 0.813 . . . . 0.0 112.262 174.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -68.17 -46.1 71.67 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.761 -0.587 . . . . 0.0 110.277 174.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.14 88.1 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.482 0.583 . . . . 0.0 112.106 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -62.69 -48.44 79.29 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.293 1.437 . . . . 0.0 111.466 177.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 57.2 t -70.28 -32.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.125 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.48 -46.03 88.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.434 1.47 . . . . 0.0 111.655 172.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -66.28 -38.11 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 118.822 0.737 . . . . 0.0 110.9 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -61.37 -50.57 72.35 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.535 -0.728 . . . . 0.0 111.977 174.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -62.9 -36.99 85.16 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.213 0.605 . . . . 0.0 111.957 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.18 -57.23 13.97 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.869 0.868 . . . . 0.0 111.152 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -54.11 -46.08 72.03 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.041 0.837 . . . . 0.0 111.942 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.21 -46.64 79.86 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.66 0.664 . . . . 0.0 111.793 -173.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.15 -46.19 85.16 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.514 0.726 . . . . 0.0 111.615 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -58.81 -50.78 72.68 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 122.01 -0.431 . . . . 0.0 110.944 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -54.79 -40.61 69.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.025 1.33 . . . . 0.0 112.236 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -69.63 -31.46 69.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.942 0.897 . . . . 0.0 113.02 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.4 m -82.67 -31.47 28.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -149.11 104.28 3.35 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 127.779 2.432 . . . . 0.0 109.43 -169.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.47 4.42 5.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.878 3.719 . . . . 0.0 116.717 -157.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 p-90 -89.63 -23.38 21.93 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.6 tp -65.89 140.01 58.32 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -158.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -92.18 138.64 31.36 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.201 1.0 . . . . 0.0 111.606 172.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.1 tt -84.37 117.13 23.41 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.66 1.184 . . . . 0.0 108.274 175.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -123.59 112.42 17.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.777 0.831 . . . . 0.0 110.94 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -152.28 141.95 21.85 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.298 1.047 . . . . 0.0 112.49 164.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.3 t -157.79 170.1 23.12 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 128.993 2.917 . . . . 0.0 107.217 173.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -49.7 -39.28 36.39 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.12 -0.988 . . . . 0.0 112.592 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -61.39 -44.06 97.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 112.1 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.51 -39.67 94.21 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.604 0.762 . . . . 0.0 112.028 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.29 -46.58 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 122.001 -0.437 . . . . 0.0 109.969 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -71.24 -21.36 62.12 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -79.81 -42.78 23.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.872 1.269 . . . . 0.0 112.76 172.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.61 -42.37 82.53 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.664 0.665 . . . . 0.0 112.248 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -127.84 84.69 62.61 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.36 1.464 . . . . 0.0 109.952 -166.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -69.25 -11.1 30.7 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.298 2.666 . . . . 0.0 114.485 -167.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.2 p-80 -82.67 -7.4 59.65 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 175.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.08 -35.21 28.88 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.349 0.977 . . . . 0.0 112.641 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.0 ptt180 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 117.792 -1.099 . . . . 0.0 113.086 168.722 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -116.81 150.73 37.86 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.5 mt -123.13 149.86 43.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.843 1.657 . . . . 0.0 112.176 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -70.34 141.56 52.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.109 0.964 . . . . 0.0 110.45 162.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.07 -17.1 15.07 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -172.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.99 159.98 40.85 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.58 1.152 . . . . 0.0 112.982 -170.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.46 -163.41 53.09 Favored Glycine 0 CA--C 1.542 1.755 0 C-N-CA 124.396 0.998 . . . . 0.0 114.397 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -59.73 -24.11 74.36 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.524 2.816 . . . . 0.0 113.86 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -5.98 59.34 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.659 1.583 . . . . 0.0 113.641 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.73 17.69 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.87 1.213 . . . . 0.0 112.148 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.75 -1.15 80.76 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 115.904 1.122 . . . . 0.0 115.904 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.4 mt -107.1 153.1 41.21 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.009 1.404 . . . . 0.0 112.221 -174.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -57.08 143.91 91.54 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.311 3.341 . . . . 0.0 113.123 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.4 t -78.13 -29.46 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.308 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -139.02 166.44 24.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.584 1.154 . . . . 0.0 112.86 -173.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.42 -34.69 72.8 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.612 -0.68 . . . . 0.0 111.989 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.7 t -70.76 -39.47 73.23 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.06 0.544 . . . . 0.0 111.728 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.17 -44.66 96.11 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.367 -0.833 . . . . 0.0 110.722 171.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.26 -47.18 87.09 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.546 -0.721 . . . . 0.0 112.641 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -56.55 -47.12 80.14 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.643 . . . . 0.0 111.891 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 43.3 t -77.45 -30.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 118.342 -0.837 . . . . 0.0 112.613 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.04 -44.64 97.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.721 1.601 . . . . 0.0 111.22 169.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.53 -41.41 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.367 0.53 . . . . 0.0 110.952 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -60.29 -48.76 80.38 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.945 0.793 . . . . 0.0 112.288 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -64.71 -39.81 94.29 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 118.949 0.795 . . . . 0.0 111.989 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -58.68 -53.16 61.52 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.944 0.897 . . . . 0.0 111.146 171.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -55.56 -45.54 77.28 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.74 174.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -48.72 79.88 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.514 1.052 . . . . 0.0 111.733 -175.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.29 -49.33 77.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.027 0.531 . . . . 0.0 111.654 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -59.21 -52.49 65.47 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 119.093 -0.479 . . . . 0.0 111.144 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -51.87 -44.1 63.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.163 1.785 . . . . 0.0 112.282 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -73.3 -26.06 60.91 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -85.95 -29.49 23.54 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 169.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -151.37 105.1 2.93 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 128.387 2.675 . . . . 0.0 109.433 -168.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.2 -11.6 23.1 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 124.169 3.246 . . . . 0.0 116.583 -160.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -68.2 -25.78 65.4 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -172.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.8 tp -70.82 144.82 50.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -158.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -105.6 143.56 33.59 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.928 1.691 . . . . 0.0 111.594 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.418 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -93.31 119.31 32.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.202 1.401 . . . . 0.0 109.73 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -135.15 120.01 18.49 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.535 1.134 . . . . 0.0 111.672 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.418 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.67 50.13 0.75 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.786 1.234 . . . . 0.0 112.962 -176.649 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.0 m -66.96 161.5 24.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.683 0.793 . . . . 0.0 111.354 164.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -51.66 -39.57 58.42 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.179 -0.951 . . . . 0.0 112.99 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.7 -41.19 94.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 112.729 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.07 -38.73 91.73 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.218 0.917 . . . . 0.0 111.715 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.81 -46.95 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.289 177.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -69.98 -29.45 66.56 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -72.14 -40.23 68.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.162 0.985 . . . . 0.0 112.827 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -74.15 -41.56 61.33 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.805 0.729 . . . . 0.0 112.138 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -128.17 91.63 43.9 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.32 1.848 . . . . 0.0 110.282 -172.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.26 -14.98 35.1 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.182 2.588 . . . . 0.0 114.669 -167.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -81.23 -5.54 57.87 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.27 -29.04 21.95 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 . . . . . 0 C--O 1.256 1.403 0 CA-C-N 119.62 1.1 . . . . 0.0 112.881 178.327 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.56 152.11 22.8 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.34 150.66 46.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.737 1.615 . . . . 0.0 112.128 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -69.72 132.16 45.7 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.745 0.818 . . . . 0.0 109.981 162.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -25.57 17.37 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.27 164.36 30.46 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.195 1.398 . . . . 0.0 112.392 -171.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.46 -166.16 54.62 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.292 0.948 . . . . 0.0 114.48 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.26 -28.64 72.53 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.033 3.156 . . . . 0.0 114.646 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.12 2.95 55.22 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.046 1.338 . . . . 0.0 113.511 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.69 127.1 15.15 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 119.133 0.879 . . . . 0.0 112.323 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.45 -3.64 79.27 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 115.953 1.141 . . . . 0.0 115.953 -177.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 mt -107.37 155.04 40.22 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 118.966 1.383 . . . . 0.0 112.56 -172.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -57.19 144.41 90.63 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.278 3.319 . . . . 0.0 113.015 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 38.2 t -80.11 -28.81 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 122.376 0.27 . . . . 0.0 111.327 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.4 p -139.15 166.08 25.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.574 1.15 . . . . 0.0 112.88 -173.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -60.79 -36.41 78.93 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 173.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.9 t -65.21 -44.87 86.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.849 0.86 . . . . 0.0 111.36 174.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -60.89 -43.55 98.31 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.469 -0.769 . . . . 0.0 111.078 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.34 81.21 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.47 -0.769 . . . . 0.0 112.634 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.5 ttt85 -61.16 -41.5 96.88 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.937 1.295 . . . . 0.0 111.893 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.31 -34.26 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.182 -0.914 . . . . 0.0 112.211 177.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 47.0 mt -61.31 -45.64 93.6 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.878 1.672 . . . . 0.0 111.355 171.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.17 -43.87 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 117.974 0.352 . . . . 0.0 110.47 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -58.62 -49.79 76.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.256 0.48 . . . . 0.0 112.12 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.31 -36.47 71.63 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.521 -0.737 . . . . 0.0 112.271 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -60.84 -50.78 72.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 118.463 -0.78 . . . . 0.0 110.728 169.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -53.18 -43.7 67.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.419 1.009 . . . . 0.0 111.665 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -63.67 -45.04 91.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 120.076 1.307 . . . . 0.0 112.237 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.1 -46.27 81.76 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.545 -0.722 . . . . 0.0 112.615 173.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -59.87 -48.09 83.09 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.592 -0.693 . . . . 0.0 110.493 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -57.34 -42.15 81.39 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.255 1.822 . . . . 0.0 111.986 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -59.55 -44.93 93.11 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.311 0.645 . . . . 0.0 112.451 170.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.7 m -77.09 -29.16 54.83 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -151.43 107.35 2.94 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 127.806 2.443 . . . . 0.0 109.312 -168.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.23 -14.48 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.826 3.017 . . . . 0.0 116.113 -160.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -70.96 -25.37 62.69 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -171.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -67.66 145.97 54.28 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -157.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -109.51 144.92 37.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.261 1.824 . . . . 0.0 111.5 173.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.435 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -98.18 122.2 41.04 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.85 1.66 . . . . 0.0 109.995 -177.199 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -137.59 120.35 16.31 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.658 1.183 . . . . 0.0 111.882 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.435 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.11 55.24 0.65 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.512 1.125 . . . . 0.0 113.385 -176.091 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.3 t -66.14 157.01 32.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.611 0.764 . . . . 0.0 110.913 161.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -54.26 -32.43 56.1 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.905 -1.122 . . . . 0.0 112.719 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.23 -41.32 96.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.062 0.945 . . . . 0.0 112.579 171.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.01 -38.22 87.92 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.601 0.76 . . . . 0.0 111.73 174.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.71 -47.14 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.302 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.76 -32.37 72.92 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.777 0.717 . . . . 0.0 112.385 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -69.02 -40.82 78.44 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.586 0.754 . . . . 0.0 112.625 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 78.6 mtt-85 -72.72 -39.32 67.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.965 0.906 . . . . 0.0 112.736 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -133.67 85.06 43.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.155 1.782 . . . . 0.0 109.979 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.97 -13.74 37.2 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.25 2.633 . . . . 0.0 114.611 -167.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -77.29 -8.86 58.32 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.78 -29.59 23.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 . . . . . 0 C--O 1.254 1.316 0 CA-C-N 119.42 1.009 . . . . 0.0 112.94 179.002 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -103.95 150.54 24.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.98 148.83 45.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.488 1.515 . . . . 0.0 112.02 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.62 142.05 53.56 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.057 0.943 . . . . 0.0 110.462 162.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.0 -15.57 15.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -137.95 158.64 43.92 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.462 1.105 . . . . 0.0 113.388 -169.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.79 -161.93 51.19 Favored Glycine 0 CA--C 1.542 1.724 0 C-N-CA 124.494 1.045 . . . . 0.0 114.411 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.16 -24.33 73.36 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.441 2.761 . . . . 0.0 113.91 179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.78 -6.85 59.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.541 1.537 . . . . 0.0 113.523 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 125.09 16.05 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.007 1.276 . . . . 0.0 112.056 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.89 -0.5 79.47 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 116.121 1.208 . . . . 0.0 116.121 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 27.7 mt -106.56 152.96 40.86 Favored Pre-proline 0 CA--C 1.55 0.963 0 CA-C-N 118.924 1.362 . . . . 0.0 112.284 -174.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -56.97 143.42 92.44 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.505 3.47 . . . . 0.0 112.952 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.1 t -77.96 -39.33 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.899 -0.5 . . . . 0.0 111.452 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.1 t -134.67 164.15 28.17 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.254 1.422 . . . . 0.0 112.678 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -59.97 -27.23 66.66 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.003 -1.061 . . . . 0.0 112.833 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.5 m -68.86 -35.34 76.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 171.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -65.17 -44.56 88.08 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.257 0.935 . . . . 0.0 109.736 169.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.99 93.37 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 -56.32 -48.54 76.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.822 1.649 . . . . 0.0 111.502 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.5 t -73.89 -33.45 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 118.546 -0.74 . . . . 0.0 112.186 -178.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.13 -47.97 82.2 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 120.262 1.392 . . . . 0.0 111.1 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.77 -43.37 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 122.885 0.474 . . . . 0.0 110.789 175.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -59.5 -52.47 65.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.747 0.819 . . . . 0.0 112.41 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -68.56 -34.65 76.2 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.678 -0.639 . . . . 0.0 112.337 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -61.47 -53.21 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.14 170.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -52.17 -45.74 65.23 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.359 172.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -64.87 -42.1 95.13 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.646 1.112 . . . . 0.0 112.679 -175.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -62.97 -47.98 80.84 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.896 0.771 . . . . 0.0 111.506 173.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.0 mmp_? -59.66 -50.84 72.3 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.715 -0.616 . . . . 0.0 110.918 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -52.46 -41.34 63.23 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.596 1.959 . . . . 0.0 112.6 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -67.59 -36.73 81.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.116 . . . . 0.0 111.874 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 t -79.49 -33.23 42.36 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 176.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -152.98 112.14 2.69 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 128.427 2.691 . . . . 0.0 109.669 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.94 -11.64 18.0 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 124.34 3.36 . . . . 0.0 116.401 -161.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -66.74 -24.84 66.28 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -172.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.91 144.16 49.07 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -159.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -103.04 147.94 26.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.048 1.739 . . . . 0.0 112.174 171.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -98.97 118.24 35.29 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.543 1.537 . . . . 0.0 109.26 -179.709 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -134.34 115.35 13.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.38 1.072 . . . . 0.0 111.922 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.415 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.13 49.43 0.78 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.84 1.256 . . . . 0.0 112.997 -175.369 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.1 t -64.21 156.31 29.11 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.809 162.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -50.28 -36.89 33.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.447 1.099 . . . . 0.0 112.029 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -61.74 -42.45 98.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.137 0.975 . . . . 0.0 112.251 174.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.04 89.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.695 0.679 . . . . 0.0 111.49 174.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.4 -45.74 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.996 -0.44 . . . . 0.0 110.342 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -68.01 -31.49 71.21 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -72.1 -40.26 68.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.281 1.032 . . . . 0.0 112.835 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -74.31 -37.28 63.67 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.754 0.822 . . . . 0.0 112.802 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -132.95 88.59 36.71 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.857 1.663 . . . . 0.0 110.205 -170.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -70.21 -10.56 28.48 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.329 2.686 . . . . 0.0 114.819 -166.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -82.81 -6.61 59.51 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.64 -32.45 23.66 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.365 0.984 . . . . 0.0 113.217 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 . . . . . 0 C--O 1.256 1.395 0 C-N-CA 123.839 0.856 . . . . 0.0 113.127 169.54 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.482 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.49 152.63 23.41 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -124.14 150.43 45.12 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.582 1.553 . . . . 0.0 111.83 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -68.34 131.66 45.71 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.543 0.737 . . . . 0.0 110.182 164.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.3 -18.4 22.49 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.49 167.49 27.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 112.904 -173.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.62 -168.86 54.81 Favored Glycine 0 CA--C 1.542 1.73 0 C-N-CA 124.105 0.86 . . . . 0.0 114.571 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.6 -28.51 75.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.166 3.244 . . . . 0.0 114.542 -174.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.3 mt -95.47 3.76 53.93 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.996 1.318 . . . . 0.0 113.507 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.29 128.94 17.79 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.941 0.791 . . . . 0.0 112.489 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.59 -5.25 82.46 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 -176.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.5 mt -106.82 155.97 38.11 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 118.919 1.359 . . . . 0.0 112.166 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -56.89 142.31 93.04 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.099 3.199 . . . . 0.0 112.88 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -78.35 -32.05 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.91 174.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -134.23 166.52 22.59 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.468 1.107 . . . . 0.0 113.304 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -62.74 -36.24 82.39 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.436 -0.79 . . . . 0.0 111.269 173.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -65.23 -41.34 94.47 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.064 0.946 . . . . 0.0 111.823 173.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -60.54 -46.0 91.79 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.878 0.763 . . . . 0.0 110.452 172.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.1 91.5 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -57.35 -46.55 83.19 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.711 1.204 . . . . 0.0 111.218 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.5 t -73.15 -32.45 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.717 0.807 . . . . 0.0 112.428 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.4 mt -62.15 -47.19 85.64 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 120.27 1.395 . . . . 0.0 110.955 170.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.05 -41.24 92.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 118.833 0.742 . . . . 0.0 110.675 176.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -59.85 -51.22 70.66 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -66.85 -39.76 87.69 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.698 -0.626 . . . . 0.0 111.521 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -56.99 -52.74 64.04 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.821 0.848 . . . . 0.0 111.201 172.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -52.52 -45.24 66.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.298 -0.858 . . . . 0.0 112.12 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -68.88 -40.67 79.09 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.717 1.144 . . . . 0.0 112.8 -174.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.72 -45.47 89.8 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.212 -0.93 . . . . 0.0 112.004 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -58.37 -52.1 67.03 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.763 -0.586 . . . . 0.0 110.653 174.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.46 -40.61 51.26 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 126.432 1.893 . . . . 0.0 112.509 173.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -69.63 -34.23 73.75 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.076 0.95 . . . . 0.0 111.771 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.0 t -78.44 -37.89 42.58 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 173.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -153.47 108.73 2.58 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.797 2.839 . . . . 0.0 109.584 -171.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 -13.87 18.35 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.007 3.138 . . . . 0.0 116.656 -160.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -65.09 -25.33 67.75 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.294 1.591 . . . . 0.0 115.294 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 34.0 tp -65.61 142.89 57.91 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -162.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 68.7 mtp85 -87.04 148.06 25.44 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.505 1.122 . . . . 0.0 113.163 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.31 108.25 19.83 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.852 1.261 . . . . 0.0 108.754 167.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -132.31 122.92 25.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.819 1.248 . . . . 0.0 110.005 173.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.83 64.21 0.79 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -175.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -65.63 162.87 17.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.076 0.95 . . . . 0.0 112.155 166.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -53.96 -36.5 62.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.849 -1.157 . . . . 0.0 111.784 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -62.77 -40.97 98.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.974 0.91 . . . . 0.0 112.402 172.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.27 91.27 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.639 1.109 . . . . 0.0 112.059 172.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -47.3 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.143 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -69.15 -30.93 69.27 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.018 0.826 . . . . 0.0 112.491 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -70.33 -37.77 74.76 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.296 1.038 . . . . 0.0 112.943 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.9 -42.73 63.27 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 119.042 0.837 . . . . 0.0 112.816 169.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -132.33 84.16 52.82 Favored Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 125.814 1.646 . . . . 0.0 110.131 -163.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.6 -14.95 40.68 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.245 2.63 . . . . 0.0 114.506 -166.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -77.17 -8.28 57.27 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.84 -21.43 23.71 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 . . . . . 0 C--O 1.253 1.282 0 CA-C-N 119.871 1.214 . . . . 0.0 112.451 175.692 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.48 154.47 32.46 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 114.538 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -126.05 149.13 49.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 112.085 -177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -70.64 142.38 51.63 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.025 0.93 . . . . 0.0 110.485 162.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.67 -14.14 14.88 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.55 158.23 44.64 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.596 1.159 . . . . 0.0 113.034 -171.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.38 -162.86 51.72 Favored Glycine 0 CA--C 1.54 1.638 0 C-N-CA 124.373 0.987 . . . . 0.0 114.442 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.3 -24.42 74.21 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.627 2.885 . . . . 0.0 113.871 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.25 -7.38 59.61 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.638 1.575 . . . . 0.0 113.68 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.41 16.88 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.796 1.18 . . . . 0.0 112.061 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.14 -0.76 79.1 Favored Glycine 0 CA--C 1.53 1.01 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.11 153.55 40.95 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 119.002 1.401 . . . . 0.0 112.144 -174.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -56.16 142.84 86.28 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 124.327 3.351 . . . . 0.0 113.071 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.2 t -77.32 -33.76 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.746 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.9 p -133.84 164.45 27.22 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.614 1.166 . . . . 0.0 113.274 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -60.57 -31.28 70.41 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.332 -0.855 . . . . 0.0 112.685 172.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.6 m -69.42 -41.42 76.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.66 173.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.25 -45.05 96.14 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.708 0.685 . . . . 0.0 110.463 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.62 85.34 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.507 0.723 . . . . 0.0 112.251 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -56.64 -45.62 81.49 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.885 1.274 . . . . 0.0 111.797 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.33 -33.87 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.532 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.85 -44.08 97.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.409 1.458 . . . . 0.0 111.193 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.43 -42.49 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.528 0.603 . . . . 0.0 110.8 174.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -60.57 -50.15 74.67 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.79 -0.569 . . . . 0.0 112.286 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -69.09 -35.1 76.1 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.571 -0.706 . . . . 0.0 112.234 -177.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.55 -56.24 23.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.262 1.025 . . . . 0.0 110.541 169.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -52.87 -45.61 67.51 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.911 173.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -67.42 -41.75 84.31 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.344 0.975 . . . . 0.0 112.238 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.49 -43.98 79.64 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.214 -0.929 . . . . 0.0 111.611 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.6 -49.56 76.01 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.654 -0.654 . . . . 0.0 110.759 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -54.96 -43.05 73.11 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.396 1.878 . . . . 0.0 112.453 175.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -63.33 -36.99 85.53 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.675 0.79 . . . . 0.0 112.146 175.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.6 m -77.64 -36.71 51.22 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -152.93 103.99 2.65 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 128.094 2.558 . . . . 0.0 109.788 -168.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.67 -13.32 22.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.095 3.197 . . . . 0.0 116.679 -160.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -65.5 -24.2 67.08 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -172.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.64 146.61 54.6 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -163.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -100.42 150.95 22.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.252 1.421 . . . . 0.0 113.232 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.409 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -109.37 117.87 35.17 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.791 1.636 . . . . 0.0 109.535 -177.451 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.29 120.48 18.9 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.555 1.142 . . . . 0.0 111.613 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.409 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -151.51 53.08 0.83 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.589 1.156 . . . . 0.0 113.043 -176.128 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.8 t -67.8 157.09 35.57 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.785 160.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -54.3 -31.6 54.44 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.853 -1.154 . . . . 0.0 112.781 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -61.52 -41.54 97.48 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 112.036 172.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.95 -38.73 89.36 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.798 0.839 . . . . 0.0 111.849 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.61 -47.44 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.318 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -67.92 -32.59 73.15 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.624 0.647 . . . . 0.0 112.264 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -69.8 -39.24 76.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.626 -0.672 . . . . 0.0 112.601 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 -71.82 -41.95 67.61 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.694 0.679 . . . . 0.0 112.649 172.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.77 83.31 61.95 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.701 1.601 . . . . 0.0 110.133 -165.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.35 -14.66 40.73 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 -166.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.7 p-80 -77.49 -8.32 57.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.52 -29.56 25.85 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.489 1.04 . . . . 0.0 113.593 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.066 0.947 . . . . 0.0 112.741 177.509 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -100.4 140.84 34.08 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 174.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.48 152.06 50.14 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.614 1.566 . . . . 0.0 112.219 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -68.11 145.39 54.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.455 1.502 . . . . 0.0 111.343 175.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.2 -13.79 14.84 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -138.76 158.96 43.26 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.568 1.147 . . . . 0.0 112.93 -171.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.19 -164.09 52.3 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 124.396 0.998 . . . . 0.0 114.436 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.98 -23.79 74.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.404 2.736 . . . . 0.0 113.844 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mp -84.27 -5.66 59.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.532 1.533 . . . . 0.0 113.76 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.91 127.28 23.13 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.992 1.269 . . . . 0.0 112.147 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.28 -7.67 80.2 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.724 1.154 . . . . 0.0 115.698 -176.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.7 mt -104.43 149.65 37.61 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 118.893 1.347 . . . . 0.0 112.058 -170.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -58.76 146.43 92.59 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 124.371 3.381 . . . . 0.0 113.019 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.85 -28.63 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.397 175.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 p -140.3 167.2 22.69 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.468 1.107 . . . . 0.0 112.823 -172.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -65.61 -33.94 77.07 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.854 0.862 . . . . 0.0 111.772 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.8 t -69.05 -42.03 76.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.561 0.744 . . . . 0.0 111.83 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -64.6 -38.46 91.07 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.502 -0.749 . . . . 0.0 111.466 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.65 -46.37 90.05 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.45 -0.781 . . . . 0.0 112.419 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -56.1 -44.49 79.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.232 1.413 . . . . 0.0 112.016 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.03 -35.44 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-O 118.4 -0.809 . . . . 0.0 112.149 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.33 -44.18 97.08 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.616 1.553 . . . . 0.0 111.361 172.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.76 -40.94 90.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 118.286 0.494 . . . . 0.0 110.863 174.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.94 -46.69 88.22 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.563 -0.711 . . . . 0.0 112.578 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.17 -38.37 90.34 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.496 0.719 . . . . 0.0 111.632 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -59.65 -55.85 29.3 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.005 169.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -54.14 -42.11 69.18 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.605 1.093 . . . . 0.0 112.692 177.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.96 -49.44 77.69 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.767 1.167 . . . . 0.0 112.649 175.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.92 -49.61 77.03 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.276 -0.89 . . . . 0.0 111.489 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmt-85 -61.22 -49.37 77.4 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.984 0.913 . . . . 0.0 110.372 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.36 -38.12 79.62 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.188 1.395 . . . . 0.0 112.565 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -66.12 -37.49 85.85 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.088 0.858 . . . . 0.0 112.311 173.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.1 m -76.81 -36.78 56.69 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -153.49 104.38 2.55 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 128.174 2.59 . . . . 0.0 109.617 -168.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.88 -13.01 24.16 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.041 3.16 . . . . 0.0 116.65 -160.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -67.94 -24.12 65.14 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -171.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -65.25 143.1 58.03 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -161.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -93.37 147.37 22.99 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.901 1.28 . . . . 0.0 111.862 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.82 118.03 36.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.497 1.519 . . . . 0.0 109.276 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.6 115.53 14.79 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.404 1.082 . . . . 0.0 111.721 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.68 49.43 0.87 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.809 1.244 . . . . 0.0 112.973 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.3 t -64.6 157.08 27.98 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.72 160.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -51.7 -38.97 57.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.212 1.005 . . . . 0.0 112.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -62.65 -37.04 84.8 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.854 0.862 . . . . 0.0 113.091 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.28 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 118.933 0.788 . . . . 0.0 111.417 173.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.53 -47.61 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.151 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -69.31 -29.56 67.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.846 0.748 . . . . 0.0 112.269 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -74.4 -36.14 63.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 175.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -78.25 -39.7 39.44 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.266 0.939 . . . . 0.0 111.967 174.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -127.36 90.29 49.18 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.313 1.845 . . . . 0.0 110.329 -172.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -71.28 -12.68 30.21 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.204 2.603 . . . . 0.0 115.086 -165.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -82.68 -5.07 58.66 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.77 -19.68 28.72 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-N 119.904 1.229 . . . . 0.0 111.167 165.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.82 153.98 33.62 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.284 1.434 . . . . 0.0 114.423 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.6 mt -124.41 149.2 46.99 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.411 1.484 . . . . 0.0 111.884 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.31 140.35 54.35 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.806 0.842 . . . . 0.0 110.182 162.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.9 -16.96 15.21 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.08 159.87 41.14 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.749 1.22 . . . . 0.0 112.959 -170.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.92 -164.1 53.59 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 124.335 0.969 . . . . 0.0 114.37 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.89 -24.15 75.14 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.611 2.874 . . . . 0.0 113.829 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -84.38 -6.19 59.36 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.826 1.65 . . . . 0.0 113.528 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.61 125.82 17.74 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 119.841 1.201 . . . . 0.0 112.13 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.35 -1.23 79.21 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 116.003 1.161 . . . . 0.0 116.003 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.5 mt -106.82 153.14 40.97 Favored Pre-proline 0 CA--C 1.55 0.957 0 CA-C-N 119.08 1.44 . . . . 0.0 112.382 -174.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -55.37 141.54 81.52 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 124.364 3.376 . . . . 0.0 112.901 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 t -76.44 -33.76 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.285 -0.259 . . . . 0.0 110.886 172.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.65 166.47 22.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.823 1.249 . . . . 0.0 113.015 -174.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -33.43 74.27 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.295 -0.878 . . . . 0.0 111.62 172.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.2 m -66.11 -40.11 90.48 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.48 0.712 . . . . 0.0 111.534 174.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -63.0 -45.63 91.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.771 0.714 . . . . 0.0 110.621 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.58 89.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.723 0.692 . . . . 0.0 112.386 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -54.18 -49.74 68.64 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.026 1.73 . . . . 0.0 111.254 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.25 -31.33 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.426 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.5 -47.44 83.96 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.431 1.469 . . . . 0.0 111.258 170.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.3 mt -62.14 -43.32 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.532 0.605 . . . . 0.0 110.69 175.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.37 -50.95 71.57 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.538 0.735 . . . . 0.0 112.325 177.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -69.04 -33.76 74.1 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.537 -0.727 . . . . 0.0 112.071 -177.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -60.43 -54.71 42.35 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.663 0.785 . . . . 0.0 110.86 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 64.0 t90 -49.83 -47.01 51.8 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.306 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -64.02 -46.46 84.38 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 120.113 1.324 . . . . 0.0 112.131 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.6 -45.59 89.63 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.555 -0.716 . . . . 0.0 111.894 175.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -57.33 -49.45 76.08 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.875 -0.516 . . . . 0.0 110.633 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt -55.62 -41.0 72.89 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.617 1.567 . . . . 0.0 112.183 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -65.76 -39.31 90.91 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -77.87 -32.75 52.15 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -155.44 111.32 2.23 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 128.288 2.635 . . . . 0.0 109.393 -166.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -75.59 -11.95 20.4 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 124.016 3.144 . . . . 0.0 116.359 -160.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.4 p-90 -67.82 -30.73 70.21 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -171.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.1 tt -72.36 141.57 48.77 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.487 0.715 . . . . 0.0 111.768 -156.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -114.55 142.23 46.7 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.357 1.463 . . . . 0.0 111.887 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.414 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -90.15 119.86 30.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.036 1.334 . . . . 0.0 110.304 -172.325 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.85 120.32 18.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.636 1.174 . . . . 0.0 111.741 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.414 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -150.19 54.76 0.92 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.962 1.305 . . . . 0.0 112.441 -177.478 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -63.79 163.41 11.76 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.346 1.058 . . . . 0.0 112.185 165.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -50.23 -44.0 53.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.996 0.919 . . . . 0.0 111.041 173.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -61.01 -44.36 97.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.466 1.106 . . . . 0.0 112.292 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -39.53 87.68 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.381 0.991 . . . . 0.0 112.464 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.69 -48.16 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.072 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -69.34 -27.17 65.12 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.815 0.734 . . . . 0.0 112.764 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -72.96 -42.02 63.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.661 1.184 . . . . 0.0 112.691 172.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.1 mtt85 -73.14 -37.42 66.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -134.84 82.63 43.26 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 126.067 1.747 . . . . 0.0 110.168 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.63 -12.13 33.81 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.32 2.68 . . . . 0.0 114.679 -168.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -79.05 -7.87 58.48 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.65 -31.14 26.34 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.611 1.096 . . . . 0.0 113.304 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 . . . . . 0 C--O 1.256 1.407 0 CA-C-N 119.386 0.994 . . . . 0.0 111.887 168.776 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.34 156.39 18.56 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -128.09 148.58 50.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -71.29 141.77 50.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.127 0.971 . . . . 0.0 110.412 163.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.59 -15.15 14.85 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.69 158.95 43.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.625 1.17 . . . . 0.0 113.087 -170.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.63 -162.84 52.08 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.444 1.021 . . . . 0.0 114.396 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.44 -24.04 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.469 2.779 . . . . 0.0 113.839 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.08 -6.61 59.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.723 1.609 . . . . 0.0 113.64 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.2 16.19 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.934 1.243 . . . . 0.0 112.029 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.26 -0.44 78.27 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 115.971 1.148 . . . . 0.0 115.971 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.7 mt -106.51 153.05 40.8 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 119.07 1.435 . . . . 0.0 112.537 -174.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -54.7 144.04 66.88 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.575 3.516 . . . . 0.0 113.213 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.7 t -80.91 -33.9 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 122.651 0.38 . . . . 0.0 110.896 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -130.97 165.77 22.43 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.763 1.225 . . . . 0.0 113.309 -175.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -62.82 -35.33 79.57 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.375 -0.828 . . . . 0.0 111.05 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.3 m -65.12 -41.46 94.86 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.157 0.983 . . . . 0.0 111.893 173.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -61.17 -46.39 90.68 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.957 0.799 . . . . 0.0 110.486 173.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.73 88.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.348 0.659 . . . . 0.0 112.51 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -61.57 -42.56 99.03 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.295 1.438 . . . . 0.0 112.099 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 67.6 t -73.83 -34.51 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.466 176.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.89 -44.21 96.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 120.492 1.496 . . . . 0.0 111.287 172.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.26 -42.99 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.214 0.461 . . . . 0.0 110.815 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -57.89 -52.81 63.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.744 0.702 . . . . 0.0 112.179 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -63.14 -41.17 99.24 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.719 0.69 . . . . 0.0 112.093 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.09 -51.21 71.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.989 0.516 . . . . 0.0 111.062 175.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.23 -45.36 72.28 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.915 171.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.12 -46.64 83.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.034 1.288 . . . . 0.0 112.204 -173.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -65.73 -42.84 90.57 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.443 -0.785 . . . . 0.0 111.882 176.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -60.4 -50.02 75.27 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.673 -0.642 . . . . 0.0 111.193 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -55.22 -40.85 71.31 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.972 1.709 . . . . 0.0 112.03 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -64.98 -40.17 94.58 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.59 0.756 . . . . 0.0 112.697 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.5 m -80.62 -29.31 36.81 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -150.98 110.15 3.07 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 128.225 2.61 . . . . 0.0 109.254 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.1 -11.52 21.3 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.765 2.977 . . . . 0.0 116.115 -161.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.7 p-90 -76.73 -19.94 57.1 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -170.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.33 147.85 45.91 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.455 1.025 . . . . 0.0 113.452 -164.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -114.02 149.66 35.07 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 125.124 1.37 . . . . 0.0 112.189 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.434 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -94.22 121.08 35.36 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.61 1.564 . . . . 0.0 109.681 -175.209 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -137.55 112.4 8.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.196 0.999 . . . . 0.0 111.945 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.434 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -149.47 51.69 0.94 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.833 1.253 . . . . 0.0 113.099 -177.025 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 t -66.2 157.34 31.65 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.74 160.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -52.71 -36.9 58.23 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.145 0.978 . . . . 0.0 112.338 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -63.58 -37.44 87.32 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.81 0.844 . . . . 0.0 112.491 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.39 91.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.962 0.801 . . . . 0.0 111.249 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.83 -46.5 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 119.018 -0.515 . . . . 0.0 110.228 177.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -71.15 -27.17 63.35 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.994 0.815 . . . . 0.0 112.719 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.67 -46.17 73.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 112.152 171.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -79.49 -30.8 42.15 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -134.4 77.79 58.91 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 126.173 1.789 . . . . 0.0 110.377 -172.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.42 -8.78 24.52 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.643 2.895 . . . . 0.0 114.997 -168.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -81.58 -9.5 59.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.54 -45.68 24.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.177 0.899 . . . . 0.0 111.848 177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 117.216 2.302 . . . . 0.0 117.216 177.558 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.7 159.12 16.46 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.611 1.565 . . . . 0.0 114.068 172.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.02 149.83 50.68 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.411 1.485 . . . . 0.0 111.538 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -68.85 130.3 42.39 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.311 0.644 . . . . 0.0 109.828 162.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.05 -24.07 17.75 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.26 164.11 31.14 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.363 1.465 . . . . 0.0 112.275 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.98 -167.41 54.67 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 124.179 0.895 . . . . 0.0 114.637 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.44 -28.32 72.59 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 124.114 3.209 . . . . 0.0 114.685 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.0 mt -95.63 2.96 54.39 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.081 1.353 . . . . 0.0 113.536 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.61 127.28 15.34 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.946 0.793 . . . . 0.0 112.396 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.81 -4.65 75.75 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -176.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.5 mt -107.11 155.4 39.35 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 118.932 1.366 . . . . 0.0 112.487 -173.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -55.04 145.5 63.42 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.337 3.358 . . . . 0.0 112.814 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.9 t -81.62 -32.05 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.062 -0.399 . . . . 0.0 110.778 171.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -134.45 167.26 21.08 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.783 1.233 . . . . 0.0 113.487 -175.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.2 mtm180 -62.57 -34.8 77.7 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 121.639 -0.663 . . . . 0.0 111.942 173.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 t -66.16 -42.73 88.6 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.607 0.763 . . . . 0.0 111.243 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -60.2 -46.71 88.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.676 -0.64 . . . . 0.0 110.672 173.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.91 88.63 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.706 0.802 . . . . 0.0 112.394 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -61.95 -42.05 98.67 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.56 1.144 . . . . 0.0 112.041 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 62.0 t -72.81 -35.08 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.336 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.06 -43.99 97.07 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.542 1.519 . . . . 0.0 111.294 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.76 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.529 0.604 . . . . 0.0 110.741 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.22 -50.26 74.35 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.841 0.746 . . . . 0.0 112.195 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -64.0 -38.52 91.38 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.438 0.695 . . . . 0.0 112.265 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.22 -53.79 53.49 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.992 0.917 . . . . 0.0 110.951 173.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 67.9 t90 -54.08 -46.27 72.0 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.264 173.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.76 -45.62 88.99 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.293 0.951 . . . . 0.0 112.39 -173.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -64.09 -49.42 72.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.758 0.823 . . . . 0.0 111.763 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -61.09 -49.15 78.49 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.817 -0.552 . . . . 0.0 111.252 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -56.93 -41.29 77.95 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.111 1.364 . . . . 0.0 112.817 175.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -64.01 -33.67 76.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.605 1.093 . . . . 0.0 112.777 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -77.6 -37.41 50.41 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 172.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -150.11 107.42 3.2 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 128.003 2.521 . . . . 0.0 109.952 -172.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.04 -12.33 23.62 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.338 3.359 . . . . 0.0 117.13 -157.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 21.7 p-90 -69.75 -19.79 63.52 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -172.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 36.1 tp -67.27 138.79 57.13 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -159.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -83.83 148.78 26.8 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.54 1.536 . . . . 0.0 111.72 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 tt -114.91 119.56 36.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.767 1.627 . . . . 0.0 109.15 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -139.12 114.5 9.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.468 1.107 . . . . 0.0 111.487 174.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.66 49.58 1.14 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.0 m -73.62 161.01 30.78 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.736 0.814 . . . . 0.0 110.993 160.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -51.84 -38.25 55.13 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.953 0.901 . . . . 0.0 113.175 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -60.0 -40.85 90.62 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.24 -38.17 89.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.74 -47.02 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.403 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -69.46 -31.79 70.31 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.947 0.794 . . . . 0.0 112.562 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -70.39 -37.2 74.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.841 0.857 . . . . 0.0 113.257 174.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -73.14 -41.22 64.2 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.03 0.832 . . . . 0.0 112.85 171.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.9 82.42 64.23 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.728 1.611 . . . . 0.0 110.156 -165.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -70.07 -10.11 27.56 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.484 2.789 . . . . 0.0 114.589 -167.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -78.52 -10.31 59.67 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.5 -31.64 32.77 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.508 1.049 . . . . 0.0 113.316 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 119.577 1.081 . . . . 0.0 112.728 171.975 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.16 151.07 26.95 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.94 149.16 44.62 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.622 1.569 . . . . 0.0 111.964 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -69.08 141.5 54.73 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.85 0.86 . . . . 0.0 110.438 162.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.51 -15.96 14.85 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -172.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.87 159.1 42.94 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.726 1.211 . . . . 0.0 113.158 -170.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.09 -163.57 52.4 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 124.364 0.983 . . . . 0.0 114.44 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.06 -24.35 73.15 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.545 2.83 . . . . 0.0 113.99 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.1 -6.82 59.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.706 1.603 . . . . 0.0 113.625 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.44 16.76 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.68 1.127 . . . . 0.0 111.967 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.36 -0.93 78.75 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 116.102 1.201 . . . . 0.0 116.102 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.59 153.21 41.52 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 119.127 1.464 . . . . 0.0 112.082 -174.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -55.09 143.49 73.74 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.435 3.423 . . . . 0.0 113.492 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.5 t -78.01 -37.8 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.983 -0.448 . . . . 0.0 111.358 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.9 t -139.06 166.1 25.39 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.367 1.467 . . . . 0.0 112.671 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -57.68 -29.44 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.094 -1.004 . . . . 0.0 112.896 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -62.38 -43.07 99.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.572 0.749 . . . . 0.0 111.941 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -64.68 -43.15 94.45 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.565 -0.71 . . . . 0.0 110.259 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.45 -46.83 88.43 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -57.12 -46.9 82.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.02 1.328 . . . . 0.0 111.417 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.4 t -72.69 -32.45 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 118.862 -0.59 . . . . 0.0 112.439 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.7 mt -65.33 -42.38 93.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.179 1.354 . . . . 0.0 111.291 171.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -40.36 88.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 118.732 0.696 . . . . 0.0 110.762 173.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -60.74 -52.04 66.79 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.776 0.716 . . . . 0.0 112.158 174.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -61.78 -39.96 93.51 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.532 0.605 . . . . 0.0 111.807 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -59.38 -54.51 45.89 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.915 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -51.62 -46.32 63.58 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.386 0.994 . . . . 0.0 111.458 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.37 -45.36 84.41 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.879 0.763 . . . . 0.0 111.953 -172.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -70.4 -42.52 71.55 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.37 -0.831 . . . . 0.0 111.927 178.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -58.48 -48.89 79.29 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 121.61 -0.681 . . . . 0.0 110.683 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -63.51 -40.01 95.92 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.516 1.527 . . . . 0.0 112.46 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -65.86 -29.91 70.44 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.865 0.757 . . . . 0.0 112.444 172.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.7 t -79.21 -37.53 37.94 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 171.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -149.04 105.67 3.38 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 127.892 2.477 . . . . 0.0 110.021 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.98 -11.63 25.58 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.648 3.566 . . . . 0.0 117.17 -157.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -69.1 -23.34 64.0 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -173.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 141.78 57.17 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -161.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -98.29 148.12 23.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.052 1.341 . . . . 0.0 111.983 172.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 tt -98.63 118.94 36.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.683 1.593 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -134.54 115.81 14.33 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 111.279 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.99 51.4 0.91 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.439 1.095 . . . . 0.0 113.406 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.4 t -63.89 155.54 30.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.709 160.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -56.98 -29.96 63.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.813 -1.179 . . . . 0.0 112.335 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -60.22 -41.85 93.97 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.424 -0.798 . . . . 0.0 112.53 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.29 86.98 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.679 0.792 . . . . 0.0 111.939 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.46 -48.1 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.514 175.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.88 -33.14 74.95 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.048 0.84 . . . . 0.0 112.288 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -69.3 -39.79 78.07 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.287 1.035 . . . . 0.0 113.002 174.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.0 -37.38 61.84 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -133.07 85.57 45.14 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 110.281 -168.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.84 -16.09 41.13 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.161 2.574 . . . . 0.0 114.619 -166.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 -75.2 -11.68 60.13 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 175.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.91 -26.93 49.36 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.095 0.861 . . . . 0.0 112.31 175.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 . . . . . 0 C--O 1.254 1.328 0 C-N-CA 128.272 2.629 . . . . 0.0 116.757 161.759 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.78 148.26 26.81 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.9 mt -123.75 151.08 43.64 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.86 1.664 . . . . 0.0 111.825 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -69.56 131.68 45.05 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.512 0.725 . . . . 0.0 109.88 161.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.43 -22.55 17.63 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -140.24 162.92 34.12 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.132 1.373 . . . . 0.0 112.647 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.14 -164.45 54.92 Favored Glycine 0 CA--C 1.542 1.771 0 C-N-CA 124.169 0.89 . . . . 0.0 114.463 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.67 -28.94 68.54 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 123.915 3.076 . . . . 0.0 114.646 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 79.9 mt -94.09 1.75 56.11 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.893 1.277 . . . . 0.0 113.542 -176.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.88 125.59 12.23 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.196 0.907 . . . . 0.0 112.268 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.95 -3.39 73.58 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 116.165 1.226 . . . . 0.0 116.165 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.2 mt -107.55 154.9 40.5 Favored Pre-proline 0 CA--C 1.551 1.006 0 CA-C-N 118.977 1.389 . . . . 0.0 112.566 -173.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -56.0 145.26 75.4 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.178 3.252 . . . . 0.0 113.008 176.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -79.18 -28.97 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.252 -0.28 . . . . 0.0 111.398 172.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.5 p -140.94 165.37 27.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.863 1.265 . . . . 0.0 112.262 -174.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -65.02 -27.08 68.56 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.172 -0.955 . . . . 0.0 112.694 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.3 t -69.07 -43.69 74.08 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.339 0.655 . . . . 0.0 111.444 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -61.96 -41.95 98.57 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.247 -0.908 . . . . 0.0 110.908 172.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.64 85.18 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.574 0.749 . . . . 0.0 112.693 176.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.5 -44.91 85.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.99 1.716 . . . . 0.0 111.757 174.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.26 -35.23 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.218 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.69 -45.27 93.56 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.605 1.548 . . . . 0.0 111.314 173.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.2 mt -62.52 -43.45 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 118.272 0.487 . . . . 0.0 110.471 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -59.73 -50.64 73.03 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.878 -0.514 . . . . 0.0 112.342 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -32.69 68.65 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.509 -0.744 . . . . 0.0 111.763 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.45 -48.88 73.63 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.611 0.765 . . . . 0.0 110.918 171.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.2 t90 -55.2 -44.69 75.57 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.788 170.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -65.8 -45.68 81.48 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 120.05 1.296 . . . . 0.0 112.093 -175.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.79 -46.57 88.99 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.945 -0.472 . . . . 0.0 111.695 174.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -58.05 -51.34 70.09 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.069 0.547 . . . . 0.0 111.156 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -53.7 -40.35 65.94 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.526 1.531 . . . . 0.0 111.968 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -68.53 -39.15 81.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.0 m -75.9 -29.36 58.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 175.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -154.2 105.02 2.42 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 128.732 2.813 . . . . 0.0 109.01 -162.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.67 -15.21 24.4 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.452 2.768 . . . . 0.0 116.164 -161.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -71.7 -25.29 62.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.7 tp -69.46 145.89 52.39 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -157.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -107.63 151.69 25.3 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.29 1.836 . . . . 0.0 111.994 172.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.42 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -105.11 119.49 39.17 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.678 1.591 . . . . 0.0 109.879 -176.297 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.79 120.47 18.35 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.609 1.163 . . . . 0.0 111.625 176.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.42 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.92 57.16 0.73 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.732 1.213 . . . . 0.0 112.639 -176.151 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 94.1 p -65.09 160.56 20.81 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.532 163.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -52.45 -39.21 60.8 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.203 -0.936 . . . . 0.0 111.279 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.1 -43.81 98.32 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.313 1.045 . . . . 0.0 112.546 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.76 85.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.665 1.121 . . . . 0.0 112.072 174.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.91 -47.12 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.117 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -68.04 -31.15 70.62 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.704 0.684 . . . . 0.0 112.639 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -71.22 -40.57 71.01 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.632 1.173 . . . . 0.0 112.964 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -73.42 -37.89 65.76 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.843 0.747 . . . . 0.0 112.937 174.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -130.72 85.34 55.99 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.853 1.661 . . . . 0.0 110.076 -168.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -70.41 -8.95 24.82 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.448 2.765 . . . . 0.0 114.852 -168.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -81.24 -9.31 59.8 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.67 -35.09 30.31 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.3 0.954 . . . . 0.0 113.223 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.315 0 CA-C-O 117.426 -1.273 . . . . 0.0 112.645 173.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.73 154.06 22.04 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.0 mt -125.77 148.81 48.98 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.442 1.497 . . . . 0.0 112.318 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -70.61 142.06 51.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.316 1.047 . . . . 0.0 110.503 163.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.91 -15.99 14.77 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -172.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.0 159.27 42.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.565 1.146 . . . . 0.0 113.07 -170.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.1 -162.91 52.75 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.385 0.993 . . . . 0.0 114.322 177.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.59 -24.18 74.15 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.46 2.773 . . . . 0.0 113.799 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.16 -6.22 59.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.655 1.582 . . . . 0.0 113.699 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.99 125.67 17.97 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.822 1.192 . . . . 0.0 111.99 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.68 -0.56 80.18 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 115.965 1.146 . . . . 0.0 115.965 -177.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.2 mt -106.78 153.38 40.79 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.1 1.45 . . . . 0.0 112.476 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -56.09 142.46 86.07 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.423 3.416 . . . . 0.0 113.07 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 t -77.82 -33.29 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.461 0.305 . . . . 0.0 110.937 173.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.18 164.72 26.72 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.787 1.235 . . . . 0.0 112.709 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.58 -29.19 70.48 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.119 -0.988 . . . . 0.0 112.53 173.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.8 m -68.36 -41.03 81.27 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.704 0.802 . . . . 0.0 111.292 173.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -61.68 -45.64 93.12 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.792 0.723 . . . . 0.0 110.588 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.41 86.28 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.262 0.625 . . . . 0.0 112.488 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -59.92 -42.18 93.37 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.425 1.49 . . . . 0.0 112.089 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.2 t -75.72 -33.12 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.385 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.63 -42.64 99.71 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.737 1.608 . . . . 0.0 111.331 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.5 mt -63.21 -42.78 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 122.991 0.517 . . . . 0.0 110.667 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -59.11 -47.03 86.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.659 0.663 . . . . 0.0 112.425 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -68.39 -37.46 80.39 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 111.998 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -63.17 -50.38 70.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.729 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -53.93 -43.61 69.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.765 1.166 . . . . 0.0 112.468 173.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -56.18 -50.62 70.67 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.971 1.26 . . . . 0.0 111.765 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.59 -48.03 73.7 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 178.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -56.07 -51.35 68.14 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.455 1.102 . . . . 0.0 110.632 176.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -44.25 80.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.463 1.505 . . . . 0.0 111.883 176.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -61.91 -33.88 75.04 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.396 0.998 . . . . 0.0 112.848 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.9 m -78.68 -38.14 40.08 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -152.21 102.97 2.78 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 127.749 2.42 . . . . 0.0 109.659 -169.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.24 -14.08 25.66 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.966 3.111 . . . . 0.0 116.576 -160.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -65.83 -24.18 66.84 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.4 tp -64.62 145.03 56.77 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.78 0.718 . . . . 0.0 112.614 -165.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -102.34 150.28 23.49 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.955 1.302 . . . . 0.0 112.406 172.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.405 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.4 OUTLIER -102.38 115.94 31.6 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 109.497 -176.781 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.59 118.48 16.25 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.467 1.107 . . . . 0.0 111.842 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.405 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -156.12 54.41 0.57 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.592 1.157 . . . . 0.0 113.429 -173.054 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 t -75.07 163.35 27.67 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.594 0.758 . . . . 0.0 111.109 163.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -50.37 -39.45 46.63 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.688 1.195 . . . . 0.0 112.714 -177.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.55 -40.03 93.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.846 0.859 . . . . 0.0 112.719 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.99 88.5 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.517 0.727 . . . . 0.0 111.558 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.01 -46.64 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.346 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -68.0 -33.18 74.13 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.447 0.567 . . . . 0.0 112.342 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.9 ttt-85 -68.37 -41.17 80.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.594 0.758 . . . . 0.0 112.393 174.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.6 mtt-85 -73.44 -37.7 65.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.859 0.864 . . . . 0.0 112.785 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -134.55 88.0 30.33 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.976 1.71 . . . . 0.0 110.33 -170.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.22 -14.54 37.98 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.177 2.585 . . . . 0.0 114.672 -167.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -78.48 -6.87 56.6 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 177.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -86.1 -30.13 22.8 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 . . . . . 0 C--O 1.255 1.39 0 CA-C-N 119.342 0.974 . . . . 0.0 113.098 178.369 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.23 154.33 31.35 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.663 1.585 . . . . 0.0 113.88 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -121.81 149.58 43.13 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.457 1.503 . . . . 0.0 111.851 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -68.33 141.14 55.89 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.911 0.884 . . . . 0.0 110.487 162.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.14 -16.69 15.17 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.14 159.85 41.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.616 1.166 . . . . 0.0 112.862 -170.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.77 -164.39 53.23 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 124.248 0.928 . . . . 0.0 114.419 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.71 -24.05 74.09 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.489 2.793 . . . . 0.0 113.943 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.37 -6.14 59.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.749 1.62 . . . . 0.0 113.691 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.66 126.04 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.825 1.193 . . . . 0.0 112.037 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.22 -1.61 80.1 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 115.987 1.155 . . . . 0.0 115.987 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.8 mt -107.28 153.32 41.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 119.063 1.431 . . . . 0.0 112.238 -174.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -56.97 144.31 89.73 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 124.315 3.343 . . . . 0.0 113.043 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.7 t -78.61 -36.12 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.596 0.358 . . . . 0.0 111.493 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.5 t -140.98 166.12 25.66 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.402 1.481 . . . . 0.0 112.838 176.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -57.21 -28.96 63.32 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.409 1.484 . . . . 0.0 113.365 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.4 t -63.99 -42.07 97.32 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.371 0.668 . . . . 0.0 111.94 171.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -65.46 -45.04 85.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.173 -0.954 . . . . 0.0 110.326 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.9 89.15 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.639 0.654 . . . . 0.0 112.396 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -60.29 -47.7 84.89 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 0.0 111.676 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 74.1 t -69.35 -34.27 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.388 -0.82 . . . . 0.0 112.277 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.6 -43.65 93.11 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.505 1.502 . . . . 0.0 111.701 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.5 mt -68.0 -37.4 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 118.622 0.646 . . . . 0.0 110.893 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.93 -49.64 76.89 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.772 0.714 . . . . 0.0 111.993 171.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.78 -39.78 90.11 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.787 0.835 . . . . 0.0 111.788 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.49 -57.73 11.49 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.853 -1.07 . . . . 0.0 111.319 171.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 60.1 t90 -52.6 -46.75 67.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.127 1.33 . . . . 0.0 112.038 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -65.37 -43.32 91.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.035 0.934 . . . . 0.0 112.302 -174.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.43 -47.94 71.57 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.578 -0.701 . . . . 0.0 111.886 175.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -59.82 -44.79 93.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.57 0.748 . . . . 0.0 110.469 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.65 -35.75 80.63 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.983 1.313 . . . . 0.0 112.474 176.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -63.78 -39.08 93.4 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.341 0.973 . . . . 0.0 112.808 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -75.58 -36.27 60.39 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 175.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -149.92 103.4 3.2 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 127.637 2.375 . . . . 0.0 109.488 -170.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 -12.52 27.02 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.187 3.258 . . . . 0.0 116.632 -159.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.9 p-90 -68.93 -23.03 64.12 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.16 132.44 50.41 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -160.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -85.01 133.02 34.26 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.192 1.397 . . . . 0.0 110.601 170.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.8 tt -79.44 118.12 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.961 0.904 . . . . 0.0 108.72 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -122.07 115.38 22.38 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.49 0.716 . . . . 0.0 111.364 171.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.9 142.3 18.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.448 1.118 . . . . 0.0 112.968 164.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -152.1 171.62 17.6 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.766 2.827 . . . . 0.0 107.169 166.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -53.98 -34.1 58.86 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.612 -1.305 . . . . 0.0 112.96 -176.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.705 0.802 . . . . 0.0 112.848 171.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.5 87.74 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.851 0.861 . . . . 0.0 111.902 174.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.67 -44.93 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.132 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -67.92 -34.81 77.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.316 0.507 . . . . 0.0 112.069 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -65.18 -43.79 90.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.15 0.98 . . . . 0.0 112.176 175.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -74.79 -40.91 60.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.392 0.677 . . . . 0.0 112.328 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -125.99 90.28 50.6 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.859 1.664 . . . . 0.0 110.39 -172.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.04 -15.87 40.14 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.07 2.513 . . . . 0.0 114.696 -166.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -79.91 -6.89 58.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.51 -28.78 26.48 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--O 1.254 1.299 0 CA-C-N 119.202 0.91 . . . . 0.0 112.86 177.603 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.53 24.97 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 176.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.67 149.97 50.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.627 1.571 . . . . 0.0 111.815 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.77 129.62 40.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.908 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.44 -17.56 22.37 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -173.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.01 167.22 27.35 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.944 1.298 . . . . 0.0 112.942 -173.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.84 -165.95 54.74 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 124.032 0.825 . . . . 0.0 114.417 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -56.06 -28.41 69.47 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.982 3.121 . . . . 0.0 114.631 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.39 3.22 54.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 0.0 113.458 -176.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.3 125.83 11.76 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.141 0.882 . . . . 0.0 112.37 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.22 -3.27 76.1 Favored Glycine 0 CA--C 1.53 0.983 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -177.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 36.4 mt -106.14 155.27 38.8 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 119.01 1.405 . . . . 0.0 112.452 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -54.53 143.83 65.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.313 3.342 . . . . 0.0 112.585 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.8 t -78.15 -32.29 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 122.121 -0.362 . . . . 0.0 110.785 170.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -135.52 165.12 26.25 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.503 1.121 . . . . 0.0 113.422 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -58.75 -32.01 68.86 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.581 0.752 . . . . 0.0 112.821 171.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.5 m -71.17 -40.66 71.13 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.935 0.894 . . . . 0.0 111.704 174.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -62.07 -43.87 97.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.787 0.721 . . . . 0.0 110.561 172.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.83 -48.27 82.34 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.402 0.681 . . . . 0.0 111.991 177.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.4 ttm-85 -56.58 -46.07 80.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.856 1.262 . . . . 0.0 111.935 175.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 69.1 t -73.47 -34.15 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.08 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.85 -44.84 88.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 120.524 1.511 . . . . 0.0 111.427 173.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -62.18 -42.69 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.175 0.59 . . . . 0.0 110.338 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -60.93 -52.14 66.3 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -63.21 -39.6 95.09 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.332 0.653 . . . . 0.0 111.696 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.89 -52.84 63.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.144 0.578 . . . . 0.0 111.004 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -55.16 -41.53 71.96 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.18 0.9 . . . . 0.0 112.864 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -65.43 -45.03 85.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.687 1.131 . . . . 0.0 111.878 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -65.99 -43.9 86.42 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.304 -0.872 . . . . 0.0 112.336 175.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.98 -48.29 82.11 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.058 0.543 . . . . 0.0 110.491 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -59.14 -33.55 71.02 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.519 1.128 . . . . 0.0 112.166 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.67 -44.67 93.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.919 0.888 . . . . 0.0 112.985 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.1 p -86.02 -28.38 24.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -151.48 103.14 2.91 Favored Pre-proline 0 CA--C 1.557 1.226 0 C-N-CA 128.693 2.797 . . . . 0.0 109.832 -176.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.84 -13.74 24.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.94 3.093 . . . . 0.0 116.767 -160.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -67.28 -24.1 65.74 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -171.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.78 144.85 56.72 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -161.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -96.69 149.89 21.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.251 1.42 . . . . 0.0 113.167 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.19 118.4 36.44 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.785 1.634 . . . . 0.0 109.213 -178.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -131.53 110.61 11.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.235 1.014 . . . . 0.0 112.07 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.08 55.2 0.99 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.193 1.397 . . . . 0.0 112.674 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 92.5 p -62.14 154.96 25.65 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.169 156.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.05 -32.09 70.59 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.48 -1.387 . . . . 0.0 111.284 178.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -57.33 -43.73 83.61 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.578 1.151 . . . . 0.0 112.457 167.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.77 76.84 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.32 0.648 . . . . 0.0 112.652 174.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.28 -48.77 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 174.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.32 -29.53 69.12 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.437 0.562 . . . . 0.0 112.258 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -70.3 -45.19 66.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.602 1.161 . . . . 0.0 112.536 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -69.85 -37.41 76.14 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 118.658 0.663 . . . . 0.0 112.749 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -130.77 84.62 58.04 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.862 1.665 . . . . 0.0 110.475 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.25 -12.86 34.85 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.307 2.671 . . . . 0.0 114.571 -168.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -76.49 -11.56 59.9 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.21 -26.66 35.74 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 119.177 0.898 . . . . 0.0 112.818 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 128.03 2.532 . . . . 0.0 116.488 167.316 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.72 153.92 32.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.419 1.488 . . . . 0.0 114.122 171.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.42 149.88 43.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.633 1.573 . . . . 0.0 111.796 -178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -69.05 141.43 54.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.897 0.879 . . . . 0.0 110.265 163.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.77 -17.71 15.46 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.33 160.22 40.33 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.645 1.178 . . . . 0.0 113.074 -170.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.04 -164.11 53.76 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 124.484 1.04 . . . . 0.0 114.45 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.79 -24.11 74.58 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.61 2.873 . . . . 0.0 113.812 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -6.17 59.35 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.759 1.624 . . . . 0.0 113.607 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.41 126.22 18.61 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.718 1.145 . . . . 0.0 112.23 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 -1.11 81.26 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -108.12 152.78 41.96 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-N 119.045 1.423 . . . . 0.0 112.363 -173.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.24 144.2 91.47 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 124.387 3.391 . . . . 0.0 113.23 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.8 t -80.48 -37.39 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 122.871 0.468 . . . . 0.0 111.537 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -139.05 168.92 18.76 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.356 1.462 . . . . 0.0 113.172 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -58.21 -35.06 71.09 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.753 1.221 . . . . 0.0 111.446 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -61.0 -39.95 91.66 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.264 1.026 . . . . 0.0 112.503 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -67.11 -47.01 72.42 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.534 -0.729 . . . . 0.0 110.005 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.19 -42.4 90.8 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.734 0.697 . . . . 0.0 112.524 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -58.96 -49.03 79.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.059 1.743 . . . . 0.0 111.703 172.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.11 -35.44 63.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-O 118.632 -0.699 . . . . 0.0 112.346 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.0 -48.64 79.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.069 1.304 . . . . 0.0 110.947 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.4 mt -63.01 -41.05 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.757 0.708 . . . . 0.0 110.94 176.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -55.14 37.74 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 122.957 0.503 . . . . 0.0 110.974 176.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -65.29 -36.03 82.83 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.828 -1.17 . . . . 0.0 112.682 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -56.85 -55.61 32.24 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.211 1.004 . . . . 0.0 110.935 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 56.3 t90 -51.85 -43.36 63.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.756 169.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -64.52 -46.93 80.8 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.731 1.15 . . . . 0.0 112.211 -173.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.03 -41.08 82.67 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.341 -0.849 . . . . 0.0 111.725 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.95 -50.46 73.98 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.581 -0.699 . . . . 0.0 111.098 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? -58.09 -39.9 79.76 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.607 1.963 . . . . 0.0 112.702 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -64.69 -35.79 82.17 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 118.899 0.772 . . . . 0.0 112.423 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.5 t -77.05 -37.57 54.41 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 174.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -150.52 106.98 3.11 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 128.127 2.571 . . . . 0.0 109.796 -172.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.55 -12.59 22.53 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.463 3.442 . . . . 0.0 116.919 -159.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -66.05 -25.02 66.85 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -174.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.1 tp -66.5 142.85 57.4 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -164.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -104.19 143.58 32.75 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.041 1.336 . . . . 0.0 111.949 175.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.423 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -93.64 119.84 33.15 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.226 1.41 . . . . 0.0 109.78 -178.561 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -135.1 120.62 19.27 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.551 1.141 . . . . 0.0 111.609 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.423 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.01 52.17 0.8 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.72 1.208 . . . . 0.0 112.876 -176.153 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.7 m -68.02 161.29 27.01 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.267 164.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -52.15 -38.52 57.84 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.991 -1.068 . . . . 0.0 113.075 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.73 -39.07 90.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.068 0.947 . . . . 0.0 112.787 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.1 -39.32 89.89 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.828 0.74 . . . . 0.0 111.485 174.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.26 -46.07 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.51 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.26 -30.09 67.05 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.479 0.581 . . . . 0.0 112.424 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -71.42 -40.24 70.56 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.748 0.819 . . . . 0.0 112.509 173.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 28.6 mmm-85 -68.93 -41.46 78.08 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.841 0.856 . . . . 0.0 112.127 173.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -136.38 90.57 17.48 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.576 1.55 . . . . 0.0 110.616 -168.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.13 -16.31 40.12 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.072 2.515 . . . . 0.0 114.795 -167.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -78.46 -6.51 55.54 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -85.95 -24.58 26.48 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 C--O 1.252 1.205 0 CA-C-N 119.76 1.164 . . . . 0.0 112.542 179.262 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.72 156.19 29.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.568 1.547 . . . . 0.0 114.262 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -128.81 149.87 50.55 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.579 1.552 . . . . 0.0 112.069 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -69.82 132.32 45.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.978 0.911 . . . . 0.0 109.977 163.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.12 -24.34 16.9 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -175.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.11 163.85 31.86 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.072 1.349 . . . . 0.0 112.519 -171.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.18 -166.21 54.77 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.08 0.847 . . . . 0.0 114.494 176.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.99 -28.7 70.3 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.043 3.162 . . . . 0.0 114.634 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.2 mt -94.93 2.8 55.44 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.981 1.312 . . . . 0.0 113.478 -176.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.77 126.68 14.41 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.198 0.908 . . . . 0.0 112.328 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.89 -3.4 77.48 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.5 mt -107.59 155.17 40.16 Favored Pre-proline 0 CA--C 1.552 1.042 0 CA-C-N 119.068 1.434 . . . . 0.0 112.599 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -55.34 144.07 73.59 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 124.333 3.355 . . . . 0.0 112.945 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.89 -32.95 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 122.147 -0.346 . . . . 0.0 110.848 172.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.0 p -133.37 164.11 27.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.899 1.28 . . . . 0.0 112.75 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -65.79 -25.78 67.4 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.912 -1.117 . . . . 0.0 112.843 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.8 t -68.27 -44.05 76.41 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.351 0.66 . . . . 0.0 111.098 170.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -59.17 -43.96 92.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.69 0.677 . . . . 0.0 110.643 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.63 84.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.495 0.718 . . . . 0.0 112.638 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -58.44 -43.82 88.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.127 0.971 . . . . 0.0 111.903 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.1 t -73.86 -31.9 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.523 179.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.7 mt -65.75 -42.57 90.75 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.659 1.572 . . . . 0.0 111.472 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -63.22 -41.79 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 118.52 0.6 . . . . 0.0 110.505 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -60.11 -50.16 74.78 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.76 -0.587 . . . . 0.0 112.312 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.83 -36.76 83.09 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 118.77 0.714 . . . . 0.0 111.952 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -59.51 -54.07 50.85 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.702 169.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -52.07 -43.65 63.95 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 119.218 0.917 . . . . 0.0 111.886 173.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.17 -48.67 79.02 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.834 0.853 . . . . 0.0 111.592 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.13 -44.59 79.45 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.539 -0.726 . . . . 0.0 112.335 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -57.33 -50.0 74.34 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.394 0.678 . . . . 0.0 110.363 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.52 -41.22 89.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.849 1.66 . . . . 0.0 112.333 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.12 -33.08 74.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.612 0.765 . . . . 0.0 112.529 174.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.5 m -82.19 -35.41 28.35 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -151.14 102.81 2.98 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 127.746 2.418 . . . . 0.0 109.732 -168.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.57 -12.8 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.241 3.294 . . . . 0.0 116.781 -158.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.2 p-90 -66.33 -25.4 66.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -172.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.0 tp -67.65 145.54 54.72 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -161.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -101.75 149.47 24.13 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.458 1.503 . . . . 0.0 112.47 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.87 116.31 32.42 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.793 1.637 . . . . 0.0 109.191 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.51 117.63 15.44 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.637 1.175 . . . . 0.0 111.309 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.59 51.19 0.76 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -66.94 159.58 28.15 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.235 0.614 . . . . 0.0 111.289 163.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -50.35 -38.37 41.81 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.809 1.244 . . . . 0.0 112.335 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -62.36 -39.26 92.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.121 0.969 . . . . 0.0 113.018 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.22 85.86 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.525 0.73 . . . . 0.0 111.611 173.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.65 -48.02 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.211 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -67.01 -31.07 71.38 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.8 0.727 . . . . 0.0 112.212 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -68.65 -42.24 78.24 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.134 0.974 . . . . 0.0 112.787 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -71.72 -42.83 66.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -130.68 81.24 68.1 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.04 1.736 . . . . 0.0 109.96 -163.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.14 -14.37 40.54 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.198 2.599 . . . . 0.0 114.528 -167.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 34.8 p-80 -74.95 -10.36 59.41 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.21 -26.87 28.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.471 1.032 . . . . 0.0 113.734 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.23 0 CA-C-N 119.231 0.923 . . . . 0.0 111.587 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.88 153.0 21.95 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -124.59 148.7 47.7 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.404 1.481 . . . . 0.0 112.021 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -69.88 141.6 53.14 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 110.327 162.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.62 -13.3 15.08 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -172.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.51 158.15 44.82 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.679 1.191 . . . . 0.0 112.893 -171.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.25 -163.0 51.45 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.431 1.015 . . . . 0.0 114.487 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.37 -24.09 73.04 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.522 2.814 . . . . 0.0 113.952 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.63 -7.13 59.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.647 1.579 . . . . 0.0 113.647 178.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.77 125.14 15.87 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.806 1.185 . . . . 0.0 112.027 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.2 -1.21 76.67 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 116.117 1.207 . . . . 0.0 116.117 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.0 mt -106.84 152.81 41.0 Favored Pre-proline 0 CA--C 1.549 0.938 0 CA-C-N 119.07 1.435 . . . . 0.0 112.452 -174.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -55.26 142.84 77.99 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 124.471 3.447 . . . . 0.0 112.866 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.3 t -78.02 -33.61 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.746 172.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.8 p -133.38 164.67 26.59 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.649 1.18 . . . . 0.0 113.185 -175.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -32.77 70.25 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.314 -0.866 . . . . 0.0 112.337 172.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -71.41 -38.7 71.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.929 0.892 . . . . 0.0 111.656 176.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -61.68 -45.22 94.92 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.826 0.739 . . . . 0.0 110.341 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.85 -46.84 89.0 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.223 0.609 . . . . 0.0 112.273 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -57.16 -44.8 83.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.145 1.378 . . . . 0.0 112.001 175.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.0 t -76.57 -32.34 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-O 118.563 -0.732 . . . . 0.0 112.29 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.8 mt -62.57 -44.16 97.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.417 1.462 . . . . 0.0 111.067 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.13 -40.8 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 118.658 0.663 . . . . 0.0 111.026 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -61.36 -48.64 80.36 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.68 -0.637 . . . . 0.0 112.314 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -65.17 -39.61 93.14 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.722 0.692 . . . . 0.0 111.909 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -55.87 -56.64 18.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.755 1.222 . . . . 0.0 110.667 173.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -51.44 -47.11 63.17 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 118.317 -0.849 . . . . 0.0 112.45 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.6 -47.82 79.88 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.879 1.218 . . . . 0.0 112.375 -173.216 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.0 -43.8 86.67 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.526 -0.734 . . . . 0.0 111.812 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -58.55 -52.96 63.42 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.844 -0.535 . . . . 0.0 110.998 175.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.3 tmtt? -54.73 -41.84 70.86 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.107 1.763 . . . . 0.0 112.613 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -67.6 -32.44 73.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.864 0.757 . . . . 0.0 112.806 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.3 t -78.07 -38.48 44.2 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 173.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -154.28 109.34 2.43 Favored Pre-proline 0 CA--C 1.554 1.108 0 C-N-CA 129.099 2.96 . . . . 0.0 109.482 -172.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.45 -13.72 22.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.182 3.255 . . . . 0.0 116.727 -160.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -67.43 -21.81 65.55 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.24 132.67 45.29 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.331 0.969 . . . . 0.0 110.81 -167.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -96.43 134.73 39.23 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.787 1.235 . . . . 0.0 112.413 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.411 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -83.16 119.14 24.15 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.88 1.272 . . . . 0.0 110.117 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -137.07 121.33 18.03 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.832 1.253 . . . . 0.0 111.579 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.411 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.2 55.55 0.76 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.638 1.175 . . . . 0.0 113.19 -177.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.9 t -63.82 153.27 37.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.464 158.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -54.9 -31.25 59.83 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.064 -1.022 . . . . 0.0 112.261 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.55 -41.5 94.64 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.871 0.869 . . . . 0.0 112.604 171.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.0 -37.64 88.34 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.776 0.83 . . . . 0.0 111.76 173.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -48.89 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.348 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -67.93 -30.46 69.78 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.688 0.677 . . . . 0.0 112.247 -178.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.56 -45.03 76.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.208 1.003 . . . . 0.0 112.379 172.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -71.81 -36.09 70.15 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.427 0.691 . . . . 0.0 112.771 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -133.02 84.74 47.89 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.919 1.688 . . . . 0.0 110.506 -169.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 -9.13 24.2 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.397 2.731 . . . . 0.0 114.979 -167.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 32.8 p-80 -81.44 -7.39 59.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.69 -36.97 28.1 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.273 0.942 . . . . 0.0 113.122 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.293 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.736 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -105.75 153.06 22.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.887 1.44 . . . . 0.0 114.887 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.9 mt -127.9 149.94 50.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.675 1.59 . . . . 0.0 111.977 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -70.19 131.04 43.63 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.602 0.761 . . . . 0.0 109.848 162.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.5 -25.18 17.71 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -175.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.36 164.55 29.95 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.307 1.443 . . . . 0.0 112.438 -171.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.29 -165.47 54.57 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.157 0.884 . . . . 0.0 114.542 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.33 -28.51 72.5 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 124.066 3.178 . . . . 0.0 114.648 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.0 mt -95.9 3.49 53.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.002 1.321 . . . . 0.0 113.519 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.37 126.03 12.3 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.098 0.863 . . . . 0.0 112.45 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.0 -2.96 76.58 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.79 1.186 . . . . 0.0 116.013 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.7 mt -107.49 154.66 40.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 CA-C-N 118.996 1.398 . . . . 0.0 112.657 -172.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -54.98 143.72 71.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.574 3.516 . . . . 0.0 112.925 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -79.05 -32.56 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.077 -0.389 . . . . 0.0 111.009 172.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -133.77 164.36 27.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.862 1.265 . . . . 0.0 112.491 -176.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.62 -26.58 68.46 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.914 -1.116 . . . . 0.0 112.808 172.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.2 t -68.19 -42.32 80.09 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.278 0.631 . . . . 0.0 111.169 171.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -61.25 -44.34 97.41 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.306 -0.871 . . . . 0.0 110.814 172.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.52 -47.16 87.39 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.371 0.668 . . . . 0.0 112.437 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.5 ttt-85 -58.09 -45.92 86.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.307 1.443 . . . . 0.0 111.833 175.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -74.2 -33.7 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.297 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.42 -46.34 88.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.235 1.38 . . . . 0.0 111.192 171.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 82.4 mt -61.55 -43.41 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.461 0.573 . . . . 0.0 110.798 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.62 -51.81 67.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.577 0.751 . . . . 0.0 112.267 177.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -69.09 -34.51 75.23 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.137 -0.977 . . . . 0.0 112.198 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -62.81 -50.87 69.29 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.374 0.67 . . . . 0.0 111.395 171.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 58.2 t90 -51.65 -44.58 63.05 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.043 0.838 . . . . 0.0 111.638 170.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.12 -46.38 87.55 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.396 0.998 . . . . 0.0 111.6 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -60.86 -47.99 83.85 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.566 0.747 . . . . 0.0 112.459 174.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -60.62 -51.34 69.83 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.573 -0.704 . . . . 0.0 111.201 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -62.32 -31.92 72.61 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.271 1.428 . . . . 0.0 112.914 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.5 tptt -60.96 -45.68 93.78 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.7 1.137 . . . . 0.0 112.345 165.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.1 t -77.7 -35.41 52.17 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -147.78 105.79 3.7 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 128.666 2.786 . . . . 0.0 108.946 -172.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.24 -14.28 25.66 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.901 3.067 . . . . 0.0 116.732 -157.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -68.47 -24.05 64.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -171.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.7 tp -68.66 140.4 55.46 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -98.13 153.95 18.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.92 1.288 . . . . 0.0 112.928 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.407 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -101.09 118.53 37.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.912 1.685 . . . . 0.0 109.329 178.539 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -135.93 119.44 16.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.492 1.117 . . . . 0.0 111.323 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' MET . . . . . 0.407 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.67 52.04 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.456 1.122 . . . . 0.0 113.377 -173.893 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.5 m -67.64 159.45 29.93 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.298 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -53.46 -37.0 62.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.094 -1.003 . . . . 0.0 112.596 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -61.86 -38.73 89.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.684 0.794 . . . . 0.0 113.06 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.59 91.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.994 0.815 . . . . 0.0 111.036 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.35 -47.69 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 119.177 -0.44 . . . . 0.0 110.464 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -67.97 -31.14 70.64 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.632 0.651 . . . . 0.0 112.568 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -70.12 -40.7 74.7 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.452 -0.78 . . . . 0.0 112.667 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -77.1 -33.49 56.93 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -133.41 83.65 48.93 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.923 1.689 . . . . 0.0 110.338 -171.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.43 -12.68 34.07 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.253 2.635 . . . . 0.0 114.563 -169.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -77.49 -7.19 55.84 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.74 -30.49 21.59 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.281 0.946 . . . . 0.0 113.41 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.227 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.0 ttm . . . . . 0 N--CA 1.495 1.816 0 CA-C-O 119.694 -0.194 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.71 138.06 21.81 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 111.387 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.64 137.11 2.15 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.903 1.239 . . . . 0.0 112.703 174.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -141.31 119.76 12.33 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.608 1.163 . . . . 0.0 111.839 -176.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -92.4 -23.77 19.08 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -174.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 t60 46.0 53.37 9.17 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.482 1.913 . . . . 0.0 114.517 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -67.91 123.96 22.04 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.386 -0.821 . . . . 0.0 111.85 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -82.53 -11.46 58.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -166.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -83.18 107.56 15.82 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.354 0.979 . . . . 0.0 110.323 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -104.29 -16.62 15.11 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -173.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.02 -141.85 23.81 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 125.054 1.311 . . . . 0.0 115.649 171.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.9 t -150.13 -57.83 0.18 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.24 1.416 . . . . 0.0 110.727 170.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 75.23 3.35 69.77 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 116.276 1.27 . . . . 0.0 116.276 170.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.45 -12.91 58.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 118.989 1.394 . . . . 0.0 114.68 -172.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.01 -13.13 59.99 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 -171.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.82 138.35 54.68 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.56 153.86 21.72 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.1 mt -125.62 149.31 48.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.405 1.482 . . . . 0.0 112.06 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.85 142.01 53.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.878 0.871 . . . . 0.0 110.557 164.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.88 -8.47 15.96 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.14 161.85 40.04 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.29 1.036 . . . . 0.0 113.548 -173.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.05 -164.82 49.66 Favored Glycine 0 CA--C 1.542 1.75 0 C-N-CA 124.3 0.952 . . . . 0.0 114.378 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.78 -24.32 71.05 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.582 2.855 . . . . 0.0 113.85 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.43 -8.09 59.63 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.907 1.683 . . . . 0.0 113.861 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.47 125.67 16.99 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.654 1.116 . . . . 0.0 111.971 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.64 -1.25 78.43 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 116.189 1.236 . . . . 0.0 116.189 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.2 mt -107.37 153.9 40.95 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.02 1.41 . . . . 0.0 112.292 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -55.6 143.15 80.23 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.231 3.287 . . . . 0.0 113.193 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -79.45 -33.39 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 122.412 0.285 . . . . 0.0 111.002 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -133.31 165.36 25.0 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.3 mtt85 -52.78 -42.19 64.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.842 1.257 . . . . 0.0 111.397 170.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.4 m -71.52 -36.76 71.15 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.838 0.855 . . . . 0.0 113.116 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -61.62 -43.94 97.92 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.917 1.235 . . . . 0.0 110.502 171.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.42 -47.61 83.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.318 0.647 . . . . 0.0 112.447 178.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -55.18 -46.47 75.8 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.096 1.358 . . . . 0.0 111.845 174.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.0 t -77.29 -31.49 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 118.404 -0.808 . . . . 0.0 112.27 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.1 mt -63.43 -43.57 97.05 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.491 1.496 . . . . 0.0 111.444 169.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.9 mt -63.43 -42.2 95.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 118.257 0.48 . . . . 0.0 110.552 174.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -60.27 -49.23 78.43 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.539 0.609 . . . . 0.0 112.619 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.83 -46.19 91.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.96 0.904 . . . . 0.0 110.676 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -59.57 -52.19 66.61 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.633 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.412 ' CH2' ' HE2' ' A' ' 91' ' ' LYS . 66.1 t90 -52.99 -43.42 66.42 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.814 1.188 . . . . 0.0 112.359 175.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -68.21 -43.32 78.28 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.226 0.921 . . . . 0.0 111.835 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -63.9 -46.62 84.03 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.337 -0.852 . . . . 0.0 112.079 174.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -56.72 -48.29 78.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.521 0.728 . . . . 0.0 110.306 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.412 ' HE2' ' CH2' ' A' ' 87' ' ' TRP . 1.2 tmmt? -56.08 -39.42 72.07 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.493 1.517 . . . . 0.0 112.501 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 mtpt -66.03 -37.6 86.3 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.888 1.222 . . . . 0.0 112.728 172.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.3 m -74.57 -39.29 62.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -153.59 104.97 2.53 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 128.387 2.675 . . . . 0.0 109.297 -170.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.53 -14.21 20.1 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.613 2.875 . . . . 0.0 116.506 -160.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.3 p-90 -66.76 -22.43 66.04 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -172.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -63.38 141.4 58.78 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.739 0.7 . . . . 0.0 112.428 -166.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -95.93 141.59 29.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.661 1.184 . . . . 0.0 111.536 174.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.41 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -91.44 117.48 29.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.752 1.221 . . . . 0.0 109.234 176.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -133.93 118.1 17.51 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.473 1.109 . . . . 0.0 111.559 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.41 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.58 57.13 0.81 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.61 1.195 . . . . 0.0 112.454 -177.577 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 98.7 p -63.11 159.15 17.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.318 162.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -52.86 -39.9 62.96 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.133 -0.98 . . . . 0.0 111.381 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.97 -40.78 96.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.329 1.052 . . . . 0.0 112.77 173.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -38.76 85.94 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.887 1.221 . . . . 0.0 111.935 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.04 -47.16 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 118.854 -0.594 . . . . 0.0 110.257 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -71.73 -27.06 62.74 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.102 0.864 . . . . 0.0 112.959 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -71.48 -40.0 70.54 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.396 1.078 . . . . 0.0 112.727 172.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -74.85 -38.44 61.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -132.86 80.8 59.96 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.959 1.704 . . . . 0.0 110.231 -168.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.37 -12.54 35.21 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.24 2.627 . . . . 0.0 114.746 -168.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -78.23 -8.65 58.6 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -78.02 -36.79 48.29 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.437 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 126.587 1.955 . . . . 0.0 115.084 170.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ttt . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 118.775 -0.631 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 59.05 -172.36 0.11 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 125.928 1.691 . . . . 0.0 113.405 -176.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.33 -177.42 52.85 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.909 1.243 . . . . 0.0 114.931 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.7 m 55.9 34.66 24.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.091 1.756 . . . . 0.0 114.313 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -60.83 -34.89 75.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -172.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.9 t60 61.29 160.01 0.05 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.819 2.048 . . . . 0.0 115.015 -171.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -147.78 145.93 28.98 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.968 1.307 . . . . 0.0 111.485 170.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -96.27 -86.14 0.32 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.428 1.091 . . . . 0.0 110.659 173.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -159.12 155.36 27.11 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.101 1.761 . . . . 0.0 110.419 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -74.83 -154.83 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.399 1.48 . . . . 0.0 111.43 174.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -153.85 166.88 32.05 Favored Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.712 -1.242 . . . . 0.0 113.872 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -143.46 162.07 36.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.918 1.687 . . . . 0.0 111.899 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.24 -147.61 47.72 Favored Glycine 0 CA--C 1.537 1.423 0 O-C-N 121.755 -0.591 . . . . 0.0 112.658 -172.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.09 143.58 54.16 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.976 -0.72 . . . . 0.0 112.512 176.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -80.83 178.35 8.45 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.778 1.231 . . . . 0.0 112.143 176.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.32 140.27 22.24 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -171.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.8 153.55 25.2 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.413 1.485 . . . . 0.0 113.916 174.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.3 mt -121.33 149.92 42.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.36 1.464 . . . . 0.0 111.512 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -67.66 140.33 56.81 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.335 0.654 . . . . 0.0 110.123 162.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.16 -17.28 15.43 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.26 159.92 41.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.661 1.184 . . . . 0.0 112.835 -170.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.82 -164.26 53.36 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.354 0.978 . . . . 0.0 114.51 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.94 -24.15 75.28 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.555 2.837 . . . . 0.0 113.949 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.89 -6.78 59.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.723 1.609 . . . . 0.0 113.553 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.43 125.54 16.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.774 1.17 . . . . 0.0 112.104 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.88 -1.34 77.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 116.126 1.21 . . . . 0.0 116.126 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.3 mt -107.34 152.82 41.39 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 119.116 1.458 . . . . 0.0 112.289 -174.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -58.19 144.33 95.59 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 124.326 3.35 . . . . 0.0 112.874 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.0 t -79.48 -36.19 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 121.91 -0.493 . . . . 0.0 111.354 177.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -141.58 168.5 19.62 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.519 1.527 . . . . 0.0 112.874 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.9 -36.09 64.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.121 1.368 . . . . 0.0 111.99 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -60.31 -40.18 89.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.731 0.813 . . . . 0.0 112.262 174.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -68.17 -46.1 71.67 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.761 -0.587 . . . . 0.0 110.277 174.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.14 88.1 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.482 0.583 . . . . 0.0 112.106 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -62.69 -48.44 79.29 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.293 1.437 . . . . 0.0 111.466 177.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 57.2 t -70.28 -32.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.125 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.48 -46.03 88.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.434 1.47 . . . . 0.0 111.655 172.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -66.28 -38.11 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 118.822 0.737 . . . . 0.0 110.9 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -61.37 -50.57 72.35 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.535 -0.728 . . . . 0.0 111.977 174.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -62.9 -36.99 85.16 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.213 0.605 . . . . 0.0 111.957 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.18 -57.23 13.97 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.869 0.868 . . . . 0.0 111.152 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -54.11 -46.08 72.03 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.041 0.837 . . . . 0.0 111.942 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.21 -46.64 79.86 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.66 0.664 . . . . 0.0 111.793 -173.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.15 -46.19 85.16 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.514 0.726 . . . . 0.0 111.615 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -58.81 -50.78 72.68 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 122.01 -0.431 . . . . 0.0 110.944 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -54.79 -40.61 69.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.025 1.33 . . . . 0.0 112.236 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -69.63 -31.46 69.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.942 0.897 . . . . 0.0 113.02 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.4 m -82.67 -31.47 28.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -149.11 104.28 3.35 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 127.779 2.432 . . . . 0.0 109.43 -169.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.47 4.42 5.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.878 3.719 . . . . 0.0 116.717 -157.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 p-90 -89.63 -23.38 21.93 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.6 tp -65.89 140.01 58.32 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -158.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -92.18 138.64 31.36 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.201 1.0 . . . . 0.0 111.606 172.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.1 tt -84.37 117.13 23.41 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.66 1.184 . . . . 0.0 108.274 175.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -123.59 112.42 17.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.777 0.831 . . . . 0.0 110.94 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -152.28 141.95 21.85 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.298 1.047 . . . . 0.0 112.49 164.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.3 t -157.79 170.1 23.12 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 128.993 2.917 . . . . 0.0 107.217 173.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -49.7 -39.28 36.39 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.12 -0.988 . . . . 0.0 112.592 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -61.39 -44.06 97.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 112.1 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.51 -39.67 94.21 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.604 0.762 . . . . 0.0 112.028 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.29 -46.58 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 122.001 -0.437 . . . . 0.0 109.969 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -71.24 -21.36 62.12 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -79.81 -42.78 23.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.872 1.269 . . . . 0.0 112.76 172.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.61 -42.37 82.53 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.664 0.665 . . . . 0.0 112.248 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -127.84 84.69 62.61 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.36 1.464 . . . . 0.0 109.952 -166.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -69.25 -11.1 30.7 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.298 2.666 . . . . 0.0 114.485 -167.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.2 p-80 -82.67 -7.4 59.65 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 175.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.08 -35.21 28.88 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.349 0.977 . . . . 0.0 112.641 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.0 ptt180 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 117.792 -1.099 . . . . 0.0 113.086 168.722 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 tpt . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 119.033 -0.508 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ptt85 -143.05 168.7 19.1 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.977 1.311 . . . . 0.0 113.341 -172.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.47 63.0 2.19 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.583 1.087 . . . . 0.0 114.795 168.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.1 p -138.35 140.54 39.51 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.854 1.262 . . . . 0.0 112.717 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -158.87 139.44 12.54 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.553 1.541 . . . . 0.0 111.475 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -145.01 132.48 20.78 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.244 1.418 . . . . 0.0 110.924 174.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -155.58 147.77 23.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.828 1.251 . . . . 0.0 112.095 173.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.482 ' HE2' ' CE1' ' A' ' 10' ' ' HIS . 84.7 t60 -153.64 151.48 29.75 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.297 1.439 . . . . 0.0 111.427 167.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -145.8 136.71 24.52 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.63 1.172 . . . . 0.0 111.547 168.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.482 ' CE1' ' HE2' ' A' ' 8' ' ' HIS . 91.6 m-70 -90.08 -67.37 0.85 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.792 0.837 . . . . 0.0 112.319 177.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 75.33 119.76 0.11 Allowed Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.101 1.334 . . . . 0.0 113.507 -174.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.9 t -157.85 162.32 38.37 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.622 1.169 . . . . 0.0 112.656 -178.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 78.06 6.11 87.32 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 116.819 1.488 . . . . 0.0 116.819 168.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.85 129.66 38.67 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.012 1.406 . . . . 0.0 112.268 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -145.12 146.83 31.97 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.943 1.697 . . . . 0.0 111.876 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -160.6 154.56 22.8 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.338 1.055 . . . . 0.0 112.121 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -116.81 150.73 37.86 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.5 mt -123.13 149.86 43.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.843 1.657 . . . . 0.0 112.176 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -70.34 141.56 52.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.109 0.964 . . . . 0.0 110.45 162.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.07 -17.1 15.07 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -172.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.99 159.98 40.85 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.58 1.152 . . . . 0.0 112.982 -170.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.46 -163.41 53.09 Favored Glycine 0 CA--C 1.542 1.755 0 C-N-CA 124.396 0.998 . . . . 0.0 114.397 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -59.73 -24.11 74.36 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.524 2.816 . . . . 0.0 113.86 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -5.98 59.34 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.659 1.583 . . . . 0.0 113.641 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.73 17.69 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.87 1.213 . . . . 0.0 112.148 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.75 -1.15 80.76 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 115.904 1.122 . . . . 0.0 115.904 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.4 mt -107.1 153.1 41.21 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.009 1.404 . . . . 0.0 112.221 -174.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -57.08 143.91 91.54 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.311 3.341 . . . . 0.0 113.123 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.4 t -78.13 -29.46 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.308 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -139.02 166.44 24.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.584 1.154 . . . . 0.0 112.86 -173.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.42 -34.69 72.8 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.612 -0.68 . . . . 0.0 111.989 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.7 t -70.76 -39.47 73.23 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.06 0.544 . . . . 0.0 111.728 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.17 -44.66 96.11 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.367 -0.833 . . . . 0.0 110.722 171.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.26 -47.18 87.09 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.546 -0.721 . . . . 0.0 112.641 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -56.55 -47.12 80.14 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.643 . . . . 0.0 111.891 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 43.3 t -77.45 -30.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 118.342 -0.837 . . . . 0.0 112.613 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.04 -44.64 97.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.721 1.601 . . . . 0.0 111.22 169.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.53 -41.41 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.367 0.53 . . . . 0.0 110.952 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -60.29 -48.76 80.38 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.945 0.793 . . . . 0.0 112.288 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -64.71 -39.81 94.29 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 118.949 0.795 . . . . 0.0 111.989 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -58.68 -53.16 61.52 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.944 0.897 . . . . 0.0 111.146 171.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -55.56 -45.54 77.28 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.74 174.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -48.72 79.88 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.514 1.052 . . . . 0.0 111.733 -175.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.29 -49.33 77.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.027 0.531 . . . . 0.0 111.654 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -59.21 -52.49 65.47 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 119.093 -0.479 . . . . 0.0 111.144 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -51.87 -44.1 63.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.163 1.785 . . . . 0.0 112.282 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -73.3 -26.06 60.91 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -85.95 -29.49 23.54 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 169.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -151.37 105.1 2.93 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 128.387 2.675 . . . . 0.0 109.433 -168.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.2 -11.6 23.1 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 124.169 3.246 . . . . 0.0 116.583 -160.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -68.2 -25.78 65.4 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -172.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.8 tp -70.82 144.82 50.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -158.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -105.6 143.56 33.59 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.928 1.691 . . . . 0.0 111.594 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.418 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -93.31 119.31 32.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.202 1.401 . . . . 0.0 109.73 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -135.15 120.01 18.49 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.535 1.134 . . . . 0.0 111.672 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.418 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.67 50.13 0.75 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.786 1.234 . . . . 0.0 112.962 -176.649 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.0 m -66.96 161.5 24.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.683 0.793 . . . . 0.0 111.354 164.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -51.66 -39.57 58.42 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.179 -0.951 . . . . 0.0 112.99 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.7 -41.19 94.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 112.729 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.07 -38.73 91.73 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.218 0.917 . . . . 0.0 111.715 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.81 -46.95 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.289 177.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -69.98 -29.45 66.56 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -72.14 -40.23 68.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.162 0.985 . . . . 0.0 112.827 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -74.15 -41.56 61.33 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.805 0.729 . . . . 0.0 112.138 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -128.17 91.63 43.9 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.32 1.848 . . . . 0.0 110.282 -172.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.26 -14.98 35.1 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.182 2.588 . . . . 0.0 114.669 -167.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -81.23 -5.54 57.87 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.27 -29.04 21.95 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 . . . . . 0 C--O 1.256 1.403 0 CA-C-N 119.62 1.1 . . . . 0.0 112.881 178.327 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.498 1.975 0 N-CA-C 110.58 -0.156 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.04 162.59 40.09 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.938 1.295 . . . . 0.0 113.152 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -172.84 147.53 9.82 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 125.498 1.523 . . . . 0.0 112.371 174.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -152.95 174.13 14.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.68 1.192 . . . . 0.0 112.427 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 51.92 62.01 2.92 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.895 2.078 . . . . 0.0 113.109 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -117.11 101.57 8.58 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.876 1.271 . . . . 0.0 111.472 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -137.88 21.66 2.85 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.142 1.377 . . . . 0.0 113.242 -172.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -133.59 138.46 46.0 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.674 1.19 . . . . 0.0 112.066 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -156.18 166.02 34.69 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.031 1.332 . . . . 0.0 111.892 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 56.94 32.38 21.45 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.311 1.844 . . . . 0.0 115.279 168.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.82 -68.22 1.72 Allowed Glycine 0 CA--C 1.536 1.356 0 O-C-N 121.261 -0.899 . . . . 0.0 112.042 172.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.6 t 53.05 -159.57 0.13 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.669 1.588 . . . . 0.0 114.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.2 175.64 50.55 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 125.531 1.539 . . . . 0.0 115.336 177.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -143.73 47.29 1.46 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.603 1.561 . . . . 0.0 112.178 -173.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.63 -33.26 70.81 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.947 1.299 . . . . 0.0 113.025 -172.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.41 143.54 42.68 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.56 152.11 22.8 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.34 150.66 46.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.737 1.615 . . . . 0.0 112.128 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -69.72 132.16 45.7 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.745 0.818 . . . . 0.0 109.981 162.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -25.57 17.37 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.27 164.36 30.46 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.195 1.398 . . . . 0.0 112.392 -171.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.46 -166.16 54.62 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.292 0.948 . . . . 0.0 114.48 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.26 -28.64 72.53 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.033 3.156 . . . . 0.0 114.646 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.12 2.95 55.22 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.046 1.338 . . . . 0.0 113.511 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.69 127.1 15.15 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 119.133 0.879 . . . . 0.0 112.323 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.45 -3.64 79.27 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 115.953 1.141 . . . . 0.0 115.953 -177.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 mt -107.37 155.04 40.22 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 118.966 1.383 . . . . 0.0 112.56 -172.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -57.19 144.41 90.63 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.278 3.319 . . . . 0.0 113.015 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 38.2 t -80.11 -28.81 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 122.376 0.27 . . . . 0.0 111.327 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.4 p -139.15 166.08 25.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.574 1.15 . . . . 0.0 112.88 -173.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -60.79 -36.41 78.93 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 173.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.9 t -65.21 -44.87 86.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.849 0.86 . . . . 0.0 111.36 174.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -60.89 -43.55 98.31 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.469 -0.769 . . . . 0.0 111.078 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.34 81.21 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.47 -0.769 . . . . 0.0 112.634 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.5 ttt85 -61.16 -41.5 96.88 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.937 1.295 . . . . 0.0 111.893 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.31 -34.26 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.182 -0.914 . . . . 0.0 112.211 177.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 47.0 mt -61.31 -45.64 93.6 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.878 1.672 . . . . 0.0 111.355 171.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.17 -43.87 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 117.974 0.352 . . . . 0.0 110.47 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -58.62 -49.79 76.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.256 0.48 . . . . 0.0 112.12 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.31 -36.47 71.63 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.521 -0.737 . . . . 0.0 112.271 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -60.84 -50.78 72.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 118.463 -0.78 . . . . 0.0 110.728 169.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -53.18 -43.7 67.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.419 1.009 . . . . 0.0 111.665 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -63.67 -45.04 91.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 120.076 1.307 . . . . 0.0 112.237 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.1 -46.27 81.76 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.545 -0.722 . . . . 0.0 112.615 173.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -59.87 -48.09 83.09 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.592 -0.693 . . . . 0.0 110.493 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -57.34 -42.15 81.39 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.255 1.822 . . . . 0.0 111.986 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -59.55 -44.93 93.11 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.311 0.645 . . . . 0.0 112.451 170.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.7 m -77.09 -29.16 54.83 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -151.43 107.35 2.94 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 127.806 2.443 . . . . 0.0 109.312 -168.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.23 -14.48 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.826 3.017 . . . . 0.0 116.113 -160.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -70.96 -25.37 62.69 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -171.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -67.66 145.97 54.28 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -157.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -109.51 144.92 37.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.261 1.824 . . . . 0.0 111.5 173.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.435 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -98.18 122.2 41.04 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.85 1.66 . . . . 0.0 109.995 -177.199 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -137.59 120.35 16.31 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.658 1.183 . . . . 0.0 111.882 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.435 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.11 55.24 0.65 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.512 1.125 . . . . 0.0 113.385 -176.091 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.3 t -66.14 157.01 32.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.611 0.764 . . . . 0.0 110.913 161.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -54.26 -32.43 56.1 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.905 -1.122 . . . . 0.0 112.719 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.23 -41.32 96.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.062 0.945 . . . . 0.0 112.579 171.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.01 -38.22 87.92 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.601 0.76 . . . . 0.0 111.73 174.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.71 -47.14 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.302 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.76 -32.37 72.92 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.777 0.717 . . . . 0.0 112.385 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -69.02 -40.82 78.44 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.586 0.754 . . . . 0.0 112.625 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 78.6 mtt-85 -72.72 -39.32 67.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.965 0.906 . . . . 0.0 112.736 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -133.67 85.06 43.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.155 1.782 . . . . 0.0 109.979 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.97 -13.74 37.2 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.25 2.633 . . . . 0.0 114.611 -167.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -77.29 -8.86 58.32 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.78 -29.59 23.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 . . . . . 0 C--O 1.254 1.316 0 CA-C-N 119.42 1.009 . . . . 0.0 112.94 179.002 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 120.348 0.118 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -142.1 161.2 38.59 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.551 1.54 . . . . 0.0 112.673 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.03 158.96 23.92 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.992 1.758 . . . . 0.0 114.766 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.1 m -96.33 171.82 8.34 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.614 1.566 . . . . 0.0 112.627 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 -119.16 4.06 11.35 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -62.62 -29.93 70.97 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -162.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -66.78 134.87 53.03 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.529 0.732 . . . . 0.0 112.401 -178.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -148.92 163.49 37.32 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.616 1.566 . . . . 0.0 111.897 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -153.88 154.08 33.23 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.619 1.168 . . . . 0.0 111.698 173.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -92.34 -31.58 15.3 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.277 1.031 . . . . 0.0 113.655 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.33 147.43 42.44 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 123.876 0.75 . . . . 0.0 113.899 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.2 t -161.77 166.48 26.45 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.808 1.643 . . . . 0.0 111.286 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -175.3 159.22 27.21 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.724 -0.61 . . . . 0.0 114.578 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -108.81 23.0 15.18 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.88 1.672 . . . . 0.0 113.46 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 pp -73.28 -11.02 60.35 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -171.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.41 140.56 58.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.201 1.0 . . . . 0.0 112.882 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -103.95 150.54 24.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.98 148.83 45.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.488 1.515 . . . . 0.0 112.02 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.62 142.05 53.56 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.057 0.943 . . . . 0.0 110.462 162.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.0 -15.57 15.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -137.95 158.64 43.92 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.462 1.105 . . . . 0.0 113.388 -169.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.79 -161.93 51.19 Favored Glycine 0 CA--C 1.542 1.724 0 C-N-CA 124.494 1.045 . . . . 0.0 114.411 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.16 -24.33 73.36 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.441 2.761 . . . . 0.0 113.91 179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.78 -6.85 59.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.541 1.537 . . . . 0.0 113.523 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 125.09 16.05 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.007 1.276 . . . . 0.0 112.056 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.89 -0.5 79.47 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 116.121 1.208 . . . . 0.0 116.121 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 27.7 mt -106.56 152.96 40.86 Favored Pre-proline 0 CA--C 1.55 0.963 0 CA-C-N 118.924 1.362 . . . . 0.0 112.284 -174.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -56.97 143.42 92.44 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.505 3.47 . . . . 0.0 112.952 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.1 t -77.96 -39.33 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.899 -0.5 . . . . 0.0 111.452 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.1 t -134.67 164.15 28.17 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.254 1.422 . . . . 0.0 112.678 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -59.97 -27.23 66.66 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.003 -1.061 . . . . 0.0 112.833 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.5 m -68.86 -35.34 76.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 171.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -65.17 -44.56 88.08 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.257 0.935 . . . . 0.0 109.736 169.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.99 93.37 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 -56.32 -48.54 76.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.822 1.649 . . . . 0.0 111.502 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.5 t -73.89 -33.45 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 118.546 -0.74 . . . . 0.0 112.186 -178.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.13 -47.97 82.2 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 120.262 1.392 . . . . 0.0 111.1 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.77 -43.37 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 122.885 0.474 . . . . 0.0 110.789 175.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -59.5 -52.47 65.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.747 0.819 . . . . 0.0 112.41 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -68.56 -34.65 76.2 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.678 -0.639 . . . . 0.0 112.337 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -61.47 -53.21 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.14 170.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -52.17 -45.74 65.23 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.359 172.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -64.87 -42.1 95.13 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.646 1.112 . . . . 0.0 112.679 -175.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -62.97 -47.98 80.84 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.896 0.771 . . . . 0.0 111.506 173.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.0 mmp_? -59.66 -50.84 72.3 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.715 -0.616 . . . . 0.0 110.918 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -52.46 -41.34 63.23 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.596 1.959 . . . . 0.0 112.6 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -67.59 -36.73 81.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.116 . . . . 0.0 111.874 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 t -79.49 -33.23 42.36 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 176.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -152.98 112.14 2.69 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 128.427 2.691 . . . . 0.0 109.669 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.94 -11.64 18.0 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 124.34 3.36 . . . . 0.0 116.401 -161.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -66.74 -24.84 66.28 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -172.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.91 144.16 49.07 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -159.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -103.04 147.94 26.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.048 1.739 . . . . 0.0 112.174 171.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -98.97 118.24 35.29 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.543 1.537 . . . . 0.0 109.26 -179.709 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -134.34 115.35 13.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.38 1.072 . . . . 0.0 111.922 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.415 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.13 49.43 0.78 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.84 1.256 . . . . 0.0 112.997 -175.369 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.1 t -64.21 156.31 29.11 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.809 162.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -50.28 -36.89 33.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.447 1.099 . . . . 0.0 112.029 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -61.74 -42.45 98.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.137 0.975 . . . . 0.0 112.251 174.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.04 89.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.695 0.679 . . . . 0.0 111.49 174.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.4 -45.74 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.996 -0.44 . . . . 0.0 110.342 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -68.01 -31.49 71.21 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -72.1 -40.26 68.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.281 1.032 . . . . 0.0 112.835 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -74.31 -37.28 63.67 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.754 0.822 . . . . 0.0 112.802 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -132.95 88.59 36.71 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.857 1.663 . . . . 0.0 110.205 -170.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -70.21 -10.56 28.48 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.329 2.686 . . . . 0.0 114.819 -166.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -82.81 -6.61 59.51 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.64 -32.45 23.66 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.365 0.984 . . . . 0.0 113.217 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 . . . . . 0 C--O 1.256 1.395 0 C-N-CA 123.839 0.856 . . . . 0.0 113.127 169.54 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 120.044 -0.027 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -70.5 157.44 37.86 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.402 1.081 . . . . 0.0 112.586 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.88 109.05 0.65 Allowed Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.501 1.524 . . . . 0.0 112.634 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 t -86.2 -28.29 23.98 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.007 0.923 . . . . 0.0 113.372 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.7 166.95 21.82 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -73.33 129.88 38.97 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.579 0.751 . . . . 0.0 112.023 174.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -89.35 89.64 7.97 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.601 1.16 . . . . 0.0 109.907 172.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 53.34 37.92 26.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.552 1.541 . . . . 0.0 113.662 -175.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 63.76 117.06 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 128.318 2.647 . . . . 0.0 114.362 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.2 m170 -74.14 -22.35 59.49 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -172.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.65 -160.99 53.91 Favored Glycine 0 CA--C 1.538 1.473 0 CA-C-N 118.902 0.774 . . . . 0.0 113.898 -170.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.6 p -143.67 163.03 34.41 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.322 1.449 . . . . 0.0 112.454 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -79.03 -163.32 25.03 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.704 1.145 . . . . 0.0 114.625 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.38 51.9 0.74 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.855 1.662 . . . . 0.0 113.226 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.7 tp -75.21 -30.13 60.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.056 1.742 . . . . 0.0 112.383 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.36 142.3 50.38 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.636 -0.665 . . . . 0.0 112.693 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.49 152.63 23.41 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -124.14 150.43 45.12 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.582 1.553 . . . . 0.0 111.83 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -68.34 131.66 45.71 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.543 0.737 . . . . 0.0 110.182 164.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.3 -18.4 22.49 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.49 167.49 27.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 112.904 -173.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.62 -168.86 54.81 Favored Glycine 0 CA--C 1.542 1.73 0 C-N-CA 124.105 0.86 . . . . 0.0 114.571 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.6 -28.51 75.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.166 3.244 . . . . 0.0 114.542 -174.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.3 mt -95.47 3.76 53.93 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.996 1.318 . . . . 0.0 113.507 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.29 128.94 17.79 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.941 0.791 . . . . 0.0 112.489 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.59 -5.25 82.46 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 -176.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.5 mt -106.82 155.97 38.11 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 118.919 1.359 . . . . 0.0 112.166 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -56.89 142.31 93.04 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.099 3.199 . . . . 0.0 112.88 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -78.35 -32.05 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.91 174.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -134.23 166.52 22.59 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.468 1.107 . . . . 0.0 113.304 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -62.74 -36.24 82.39 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.436 -0.79 . . . . 0.0 111.269 173.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -65.23 -41.34 94.47 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.064 0.946 . . . . 0.0 111.823 173.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -60.54 -46.0 91.79 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.878 0.763 . . . . 0.0 110.452 172.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.1 91.5 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -57.35 -46.55 83.19 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.711 1.204 . . . . 0.0 111.218 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.5 t -73.15 -32.45 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.717 0.807 . . . . 0.0 112.428 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.4 mt -62.15 -47.19 85.64 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 120.27 1.395 . . . . 0.0 110.955 170.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.05 -41.24 92.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 118.833 0.742 . . . . 0.0 110.675 176.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -59.85 -51.22 70.66 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -66.85 -39.76 87.69 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.698 -0.626 . . . . 0.0 111.521 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -56.99 -52.74 64.04 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.821 0.848 . . . . 0.0 111.201 172.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -52.52 -45.24 66.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.298 -0.858 . . . . 0.0 112.12 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -68.88 -40.67 79.09 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.717 1.144 . . . . 0.0 112.8 -174.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.72 -45.47 89.8 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.212 -0.93 . . . . 0.0 112.004 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -58.37 -52.1 67.03 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.763 -0.586 . . . . 0.0 110.653 174.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.46 -40.61 51.26 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 126.432 1.893 . . . . 0.0 112.509 173.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -69.63 -34.23 73.75 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.076 0.95 . . . . 0.0 111.771 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.0 t -78.44 -37.89 42.58 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 173.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -153.47 108.73 2.58 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.797 2.839 . . . . 0.0 109.584 -171.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 -13.87 18.35 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.007 3.138 . . . . 0.0 116.656 -160.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -65.09 -25.33 67.75 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.294 1.591 . . . . 0.0 115.294 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 34.0 tp -65.61 142.89 57.91 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -162.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 68.7 mtp85 -87.04 148.06 25.44 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.505 1.122 . . . . 0.0 113.163 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.31 108.25 19.83 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.852 1.261 . . . . 0.0 108.754 167.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -132.31 122.92 25.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.819 1.248 . . . . 0.0 110.005 173.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.83 64.21 0.79 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -175.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -65.63 162.87 17.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.076 0.95 . . . . 0.0 112.155 166.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -53.96 -36.5 62.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.849 -1.157 . . . . 0.0 111.784 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -62.77 -40.97 98.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.974 0.91 . . . . 0.0 112.402 172.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.27 91.27 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.639 1.109 . . . . 0.0 112.059 172.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -47.3 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.143 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -69.15 -30.93 69.27 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.018 0.826 . . . . 0.0 112.491 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -70.33 -37.77 74.76 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.296 1.038 . . . . 0.0 112.943 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.9 -42.73 63.27 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 119.042 0.837 . . . . 0.0 112.816 169.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -132.33 84.16 52.82 Favored Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 125.814 1.646 . . . . 0.0 110.131 -163.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.6 -14.95 40.68 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.245 2.63 . . . . 0.0 114.506 -166.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -77.17 -8.28 57.27 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.84 -21.43 23.71 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 . . . . . 0 C--O 1.253 1.282 0 CA-C-N 119.871 1.214 . . . . 0.0 112.451 175.692 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.498 1.933 0 CA-C-O 119.99 -0.053 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 51.19 50.56 18.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 126.151 1.78 . . . . 0.0 113.917 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -162.28 -159.77 10.53 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.079 1.323 . . . . 0.0 113.604 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 t 58.92 -165.89 0.18 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.597 1.559 . . . . 0.0 113.737 -174.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 55.83 43.7 27.21 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.532 1.933 . . . . 0.0 113.384 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -80.67 144.49 32.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.479 1.112 . . . . 0.0 111.874 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -137.97 156.47 47.82 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.482 1.513 . . . . 0.0 111.877 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -107.99 127.78 54.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.672 1.189 . . . . 0.0 111.422 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -94.62 9.15 39.86 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -169.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -66.64 147.64 52.99 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 169.04 179.74 41.26 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.939 1.733 . . . . 0.0 112.132 -176.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.0 p -153.97 150.51 28.39 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -73.34 140.42 28.35 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.063 0.84 . . . . 0.0 113.27 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -153.26 167.26 29.92 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.676 1.59 . . . . 0.0 111.83 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 pp -130.43 149.8 51.94 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.259 1.424 . . . . 0.0 114.303 -174.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -153.71 151.81 30.06 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.7 1.2 . . . . 0.0 112.384 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.48 154.47 32.46 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 114.538 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -126.05 149.13 49.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 112.085 -177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -70.64 142.38 51.63 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.025 0.93 . . . . 0.0 110.485 162.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.67 -14.14 14.88 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.55 158.23 44.64 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.596 1.159 . . . . 0.0 113.034 -171.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.38 -162.86 51.72 Favored Glycine 0 CA--C 1.54 1.638 0 C-N-CA 124.373 0.987 . . . . 0.0 114.442 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.3 -24.42 74.21 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.627 2.885 . . . . 0.0 113.871 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.25 -7.38 59.61 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.638 1.575 . . . . 0.0 113.68 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.41 16.88 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.796 1.18 . . . . 0.0 112.061 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.14 -0.76 79.1 Favored Glycine 0 CA--C 1.53 1.01 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.11 153.55 40.95 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 119.002 1.401 . . . . 0.0 112.144 -174.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -56.16 142.84 86.28 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 124.327 3.351 . . . . 0.0 113.071 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.2 t -77.32 -33.76 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.746 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.9 p -133.84 164.45 27.22 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.614 1.166 . . . . 0.0 113.274 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -60.57 -31.28 70.41 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.332 -0.855 . . . . 0.0 112.685 172.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.6 m -69.42 -41.42 76.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.66 173.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.25 -45.05 96.14 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.708 0.685 . . . . 0.0 110.463 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.62 85.34 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.507 0.723 . . . . 0.0 112.251 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -56.64 -45.62 81.49 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.885 1.274 . . . . 0.0 111.797 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.33 -33.87 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.532 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.85 -44.08 97.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.409 1.458 . . . . 0.0 111.193 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.43 -42.49 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.528 0.603 . . . . 0.0 110.8 174.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -60.57 -50.15 74.67 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.79 -0.569 . . . . 0.0 112.286 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -69.09 -35.1 76.1 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.571 -0.706 . . . . 0.0 112.234 -177.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.55 -56.24 23.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.262 1.025 . . . . 0.0 110.541 169.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -52.87 -45.61 67.51 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.911 173.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -67.42 -41.75 84.31 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.344 0.975 . . . . 0.0 112.238 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.49 -43.98 79.64 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.214 -0.929 . . . . 0.0 111.611 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.6 -49.56 76.01 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.654 -0.654 . . . . 0.0 110.759 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -54.96 -43.05 73.11 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.396 1.878 . . . . 0.0 112.453 175.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -63.33 -36.99 85.53 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.675 0.79 . . . . 0.0 112.146 175.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.6 m -77.64 -36.71 51.22 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -152.93 103.99 2.65 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 128.094 2.558 . . . . 0.0 109.788 -168.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.67 -13.32 22.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.095 3.197 . . . . 0.0 116.679 -160.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -65.5 -24.2 67.08 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -172.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.64 146.61 54.6 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -163.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -100.42 150.95 22.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.252 1.421 . . . . 0.0 113.232 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.409 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -109.37 117.87 35.17 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.791 1.636 . . . . 0.0 109.535 -177.451 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.29 120.48 18.9 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.555 1.142 . . . . 0.0 111.613 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.409 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -151.51 53.08 0.83 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.589 1.156 . . . . 0.0 113.043 -176.128 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.8 t -67.8 157.09 35.57 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.785 160.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -54.3 -31.6 54.44 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.853 -1.154 . . . . 0.0 112.781 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -61.52 -41.54 97.48 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 112.036 172.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.95 -38.73 89.36 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.798 0.839 . . . . 0.0 111.849 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.61 -47.44 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.318 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -67.92 -32.59 73.15 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.624 0.647 . . . . 0.0 112.264 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -69.8 -39.24 76.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.626 -0.672 . . . . 0.0 112.601 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 -71.82 -41.95 67.61 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.694 0.679 . . . . 0.0 112.649 172.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.77 83.31 61.95 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.701 1.601 . . . . 0.0 110.133 -165.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.35 -14.66 40.73 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 -166.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.7 p-80 -77.49 -8.32 57.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.52 -29.56 25.85 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.489 1.04 . . . . 0.0 113.593 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.066 0.947 . . . . 0.0 112.741 177.509 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -146.59 150.19 35.02 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.471 1.508 . . . . 0.0 111.444 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.66 -175.43 54.91 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.624 1.106 . . . . 0.0 114.539 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.4 t -150.58 49.9 0.88 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.836 1.654 . . . . 0.0 110.212 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -119.36 32.71 5.96 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.663 1.585 . . . . 0.0 112.95 -163.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -125.77 155.48 40.97 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.13 1.772 . . . . 0.0 112.11 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -142.5 145.71 33.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.317 1.447 . . . . 0.0 112.109 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -149.32 147.09 27.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.434 1.493 . . . . 0.0 111.491 177.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -147.17 150.66 35.37 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.962 1.305 . . . . 0.0 112.131 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.543 ' CG ' ' H ' ' A' ' 11' ' ' GLY . 18.9 t-80 52.57 -154.2 0.21 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.135 1.774 . . . . 0.0 112.918 -179.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.543 ' H ' ' CG ' ' A' ' 10' ' ' HIS . . . 176.27 166.03 32.91 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.662 -1.274 . . . . 0.0 114.54 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 m -64.89 141.46 58.77 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.471 1.109 . . . . 0.0 112.976 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.38 26.48 0.21 Allowed Glycine 0 CA--C 1.535 1.334 0 N-CA-C 115.187 0.835 . . . . 0.0 115.187 -177.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.48 102.46 6.91 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.271 1.036 . . . . 0.0 111.489 -177.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 pp -81.39 -12.34 58.99 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.92 148.64 49.03 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.411 1.085 . . . . 0.0 113.186 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -100.4 140.84 34.08 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 174.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.48 152.06 50.14 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.614 1.566 . . . . 0.0 112.219 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -68.11 145.39 54.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.455 1.502 . . . . 0.0 111.343 175.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.2 -13.79 14.84 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -138.76 158.96 43.26 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.568 1.147 . . . . 0.0 112.93 -171.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.19 -164.09 52.3 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 124.396 0.998 . . . . 0.0 114.436 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.98 -23.79 74.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.404 2.736 . . . . 0.0 113.844 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mp -84.27 -5.66 59.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.532 1.533 . . . . 0.0 113.76 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.91 127.28 23.13 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.992 1.269 . . . . 0.0 112.147 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.28 -7.67 80.2 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.724 1.154 . . . . 0.0 115.698 -176.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.7 mt -104.43 149.65 37.61 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 118.893 1.347 . . . . 0.0 112.058 -170.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -58.76 146.43 92.59 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 124.371 3.381 . . . . 0.0 113.019 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.85 -28.63 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.397 175.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 p -140.3 167.2 22.69 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.468 1.107 . . . . 0.0 112.823 -172.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -65.61 -33.94 77.07 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.854 0.862 . . . . 0.0 111.772 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.8 t -69.05 -42.03 76.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.561 0.744 . . . . 0.0 111.83 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -64.6 -38.46 91.07 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.502 -0.749 . . . . 0.0 111.466 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.65 -46.37 90.05 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.45 -0.781 . . . . 0.0 112.419 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -56.1 -44.49 79.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.232 1.413 . . . . 0.0 112.016 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.03 -35.44 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-O 118.4 -0.809 . . . . 0.0 112.149 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.33 -44.18 97.08 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.616 1.553 . . . . 0.0 111.361 172.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.76 -40.94 90.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 118.286 0.494 . . . . 0.0 110.863 174.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.94 -46.69 88.22 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.563 -0.711 . . . . 0.0 112.578 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.17 -38.37 90.34 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.496 0.719 . . . . 0.0 111.632 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -59.65 -55.85 29.3 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.005 169.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -54.14 -42.11 69.18 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.605 1.093 . . . . 0.0 112.692 177.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.96 -49.44 77.69 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.767 1.167 . . . . 0.0 112.649 175.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.92 -49.61 77.03 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.276 -0.89 . . . . 0.0 111.489 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmt-85 -61.22 -49.37 77.4 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.984 0.913 . . . . 0.0 110.372 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.36 -38.12 79.62 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.188 1.395 . . . . 0.0 112.565 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -66.12 -37.49 85.85 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.088 0.858 . . . . 0.0 112.311 173.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.1 m -76.81 -36.78 56.69 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -153.49 104.38 2.55 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 128.174 2.59 . . . . 0.0 109.617 -168.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.88 -13.01 24.16 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.041 3.16 . . . . 0.0 116.65 -160.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -67.94 -24.12 65.14 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -171.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -65.25 143.1 58.03 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -161.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -93.37 147.37 22.99 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.901 1.28 . . . . 0.0 111.862 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.82 118.03 36.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.497 1.519 . . . . 0.0 109.276 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.6 115.53 14.79 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.404 1.082 . . . . 0.0 111.721 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.68 49.43 0.87 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.809 1.244 . . . . 0.0 112.973 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.3 t -64.6 157.08 27.98 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.72 160.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -51.7 -38.97 57.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.212 1.005 . . . . 0.0 112.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -62.65 -37.04 84.8 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.854 0.862 . . . . 0.0 113.091 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.28 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 118.933 0.788 . . . . 0.0 111.417 173.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.53 -47.61 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.151 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -69.31 -29.56 67.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.846 0.748 . . . . 0.0 112.269 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -74.4 -36.14 63.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 175.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -78.25 -39.7 39.44 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.266 0.939 . . . . 0.0 111.967 174.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -127.36 90.29 49.18 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.313 1.845 . . . . 0.0 110.329 -172.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -71.28 -12.68 30.21 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.204 2.603 . . . . 0.0 115.086 -165.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -82.68 -5.07 58.66 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.77 -19.68 28.72 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-N 119.904 1.229 . . . . 0.0 111.167 165.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mmt . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 119.948 -0.072 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -146.7 141.02 26.38 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.184 1.393 . . . . 0.0 111.35 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.3 -164.22 35.87 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.815 1.198 . . . . 0.0 114.026 176.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.1 m -128.6 144.59 51.18 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.935 1.294 . . . . 0.0 111.325 175.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -91.35 122.26 33.8 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.489 1.115 . . . . 0.0 111.739 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -149.06 146.24 27.64 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.605 1.562 . . . . 0.0 111.486 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -154.22 117.05 4.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.39 1.476 . . . . 0.0 110.124 170.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -135.7 6.87 3.23 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -62.33 125.97 25.73 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.217 -0.927 . . . . 0.0 112.486 -171.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -157.37 157.1 33.43 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.405 1.482 . . . . 0.0 111.662 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 76.48 167.97 26.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.1 1.333 . . . . 0.0 114.93 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -154.9 153.74 31.57 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.142 1.377 . . . . 0.0 112.647 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 78.55 131.22 0.66 Allowed Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.349 1.452 . . . . 0.0 114.754 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 49.43 41.73 21.3 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.826 1.65 . . . . 0.0 114.766 175.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.38 -43.72 88.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.493 1.117 . . . . 0.0 113.778 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.77 148.88 29.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.247 1.019 . . . . 0.0 112.254 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.82 153.98 33.62 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.284 1.434 . . . . 0.0 114.423 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.6 mt -124.41 149.2 46.99 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.411 1.484 . . . . 0.0 111.884 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.31 140.35 54.35 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.806 0.842 . . . . 0.0 110.182 162.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.9 -16.96 15.21 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.08 159.87 41.14 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.749 1.22 . . . . 0.0 112.959 -170.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.92 -164.1 53.59 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 124.335 0.969 . . . . 0.0 114.37 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.89 -24.15 75.14 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.611 2.874 . . . . 0.0 113.829 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -84.38 -6.19 59.36 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.826 1.65 . . . . 0.0 113.528 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.61 125.82 17.74 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 119.841 1.201 . . . . 0.0 112.13 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.35 -1.23 79.21 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 116.003 1.161 . . . . 0.0 116.003 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.5 mt -106.82 153.14 40.97 Favored Pre-proline 0 CA--C 1.55 0.957 0 CA-C-N 119.08 1.44 . . . . 0.0 112.382 -174.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -55.37 141.54 81.52 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 124.364 3.376 . . . . 0.0 112.901 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 t -76.44 -33.76 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.285 -0.259 . . . . 0.0 110.886 172.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.65 166.47 22.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.823 1.249 . . . . 0.0 113.015 -174.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -33.43 74.27 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.295 -0.878 . . . . 0.0 111.62 172.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.2 m -66.11 -40.11 90.48 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.48 0.712 . . . . 0.0 111.534 174.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -63.0 -45.63 91.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.771 0.714 . . . . 0.0 110.621 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.58 89.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.723 0.692 . . . . 0.0 112.386 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -54.18 -49.74 68.64 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.026 1.73 . . . . 0.0 111.254 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.25 -31.33 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.426 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.5 -47.44 83.96 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.431 1.469 . . . . 0.0 111.258 170.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.3 mt -62.14 -43.32 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.532 0.605 . . . . 0.0 110.69 175.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.37 -50.95 71.57 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.538 0.735 . . . . 0.0 112.325 177.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -69.04 -33.76 74.1 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.537 -0.727 . . . . 0.0 112.071 -177.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -60.43 -54.71 42.35 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.663 0.785 . . . . 0.0 110.86 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 64.0 t90 -49.83 -47.01 51.8 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.306 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -64.02 -46.46 84.38 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 120.113 1.324 . . . . 0.0 112.131 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.6 -45.59 89.63 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.555 -0.716 . . . . 0.0 111.894 175.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -57.33 -49.45 76.08 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.875 -0.516 . . . . 0.0 110.633 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt -55.62 -41.0 72.89 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.617 1.567 . . . . 0.0 112.183 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -65.76 -39.31 90.91 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -77.87 -32.75 52.15 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -155.44 111.32 2.23 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 128.288 2.635 . . . . 0.0 109.393 -166.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -75.59 -11.95 20.4 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 124.016 3.144 . . . . 0.0 116.359 -160.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.4 p-90 -67.82 -30.73 70.21 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -171.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.1 tt -72.36 141.57 48.77 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.487 0.715 . . . . 0.0 111.768 -156.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -114.55 142.23 46.7 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.357 1.463 . . . . 0.0 111.887 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.414 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -90.15 119.86 30.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.036 1.334 . . . . 0.0 110.304 -172.325 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.85 120.32 18.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.636 1.174 . . . . 0.0 111.741 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.414 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -150.19 54.76 0.92 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.962 1.305 . . . . 0.0 112.441 -177.478 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -63.79 163.41 11.76 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.346 1.058 . . . . 0.0 112.185 165.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -50.23 -44.0 53.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.996 0.919 . . . . 0.0 111.041 173.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -61.01 -44.36 97.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.466 1.106 . . . . 0.0 112.292 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -39.53 87.68 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.381 0.991 . . . . 0.0 112.464 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.69 -48.16 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.072 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -69.34 -27.17 65.12 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.815 0.734 . . . . 0.0 112.764 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -72.96 -42.02 63.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.661 1.184 . . . . 0.0 112.691 172.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.1 mtt85 -73.14 -37.42 66.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -134.84 82.63 43.26 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 126.067 1.747 . . . . 0.0 110.168 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.63 -12.13 33.81 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.32 2.68 . . . . 0.0 114.679 -168.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -79.05 -7.87 58.48 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.65 -31.14 26.34 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.611 1.096 . . . . 0.0 113.304 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 . . . . . 0 C--O 1.256 1.407 0 CA-C-N 119.386 0.994 . . . . 0.0 111.887 168.776 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.8 mtm . . . . . 0 N--CA 1.501 2.089 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -153.42 169.78 22.31 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.811 1.244 . . . . 0.0 113.528 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.58 -3.7 71.93 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 164.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.7 m -82.82 114.27 21.02 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.257 1.529 . . . . 0.0 111.971 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -97.01 141.53 30.05 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.239 1.016 . . . . 0.0 112.75 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -155.38 156.17 34.92 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.062 1.345 . . . . 0.0 110.442 162.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.8 p-80 -147.29 135.53 21.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.296 172.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -154.98 158.0 38.53 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.507 1.123 . . . . 0.0 111.494 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -153.64 122.75 6.5 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.566 1.546 . . . . 0.0 109.978 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.8 t-80 -155.81 157.36 36.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.262 1.025 . . . . 0.0 112.634 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 85.36 155.06 24.0 Favored Glycine 0 CA--C 1.537 1.466 0 C-N-CA 125.283 1.421 . . . . 0.0 114.859 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -153.75 170.26 21.36 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.958 1.703 . . . . 0.0 111.995 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 60.75 -120.92 24.87 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.044 0.83 . . . . 0.0 113.401 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.84 -10.76 60.24 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 55.38 -160.71 0.18 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.889 1.676 . . . . 0.0 113.915 -177.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.69 141.23 57.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -176.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.34 156.39 18.56 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -128.09 148.58 50.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -71.29 141.77 50.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.127 0.971 . . . . 0.0 110.412 163.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.59 -15.15 14.85 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.69 158.95 43.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.625 1.17 . . . . 0.0 113.087 -170.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.63 -162.84 52.08 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.444 1.021 . . . . 0.0 114.396 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.44 -24.04 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.469 2.779 . . . . 0.0 113.839 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.08 -6.61 59.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.723 1.609 . . . . 0.0 113.64 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.2 16.19 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.934 1.243 . . . . 0.0 112.029 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.26 -0.44 78.27 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 115.971 1.148 . . . . 0.0 115.971 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.7 mt -106.51 153.05 40.8 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 119.07 1.435 . . . . 0.0 112.537 -174.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -54.7 144.04 66.88 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.575 3.516 . . . . 0.0 113.213 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.7 t -80.91 -33.9 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 122.651 0.38 . . . . 0.0 110.896 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -130.97 165.77 22.43 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.763 1.225 . . . . 0.0 113.309 -175.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -62.82 -35.33 79.57 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.375 -0.828 . . . . 0.0 111.05 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.3 m -65.12 -41.46 94.86 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.157 0.983 . . . . 0.0 111.893 173.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -61.17 -46.39 90.68 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.957 0.799 . . . . 0.0 110.486 173.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.73 88.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.348 0.659 . . . . 0.0 112.51 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -61.57 -42.56 99.03 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.295 1.438 . . . . 0.0 112.099 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 67.6 t -73.83 -34.51 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.466 176.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.89 -44.21 96.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 120.492 1.496 . . . . 0.0 111.287 172.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.26 -42.99 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.214 0.461 . . . . 0.0 110.815 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -57.89 -52.81 63.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.744 0.702 . . . . 0.0 112.179 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -63.14 -41.17 99.24 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.719 0.69 . . . . 0.0 112.093 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.09 -51.21 71.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.989 0.516 . . . . 0.0 111.062 175.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.23 -45.36 72.28 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.915 171.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.12 -46.64 83.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.034 1.288 . . . . 0.0 112.204 -173.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -65.73 -42.84 90.57 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.443 -0.785 . . . . 0.0 111.882 176.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -60.4 -50.02 75.27 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.673 -0.642 . . . . 0.0 111.193 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -55.22 -40.85 71.31 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.972 1.709 . . . . 0.0 112.03 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -64.98 -40.17 94.58 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.59 0.756 . . . . 0.0 112.697 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.5 m -80.62 -29.31 36.81 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -150.98 110.15 3.07 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 128.225 2.61 . . . . 0.0 109.254 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.1 -11.52 21.3 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.765 2.977 . . . . 0.0 116.115 -161.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.7 p-90 -76.73 -19.94 57.1 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -170.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.33 147.85 45.91 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.455 1.025 . . . . 0.0 113.452 -164.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -114.02 149.66 35.07 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 125.124 1.37 . . . . 0.0 112.189 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.434 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -94.22 121.08 35.36 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.61 1.564 . . . . 0.0 109.681 -175.209 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -137.55 112.4 8.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.196 0.999 . . . . 0.0 111.945 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.434 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -149.47 51.69 0.94 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.833 1.253 . . . . 0.0 113.099 -177.025 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 t -66.2 157.34 31.65 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.74 160.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -52.71 -36.9 58.23 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.145 0.978 . . . . 0.0 112.338 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -63.58 -37.44 87.32 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.81 0.844 . . . . 0.0 112.491 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.39 91.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.962 0.801 . . . . 0.0 111.249 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.83 -46.5 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 119.018 -0.515 . . . . 0.0 110.228 177.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -71.15 -27.17 63.35 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.994 0.815 . . . . 0.0 112.719 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.67 -46.17 73.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 112.152 171.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -79.49 -30.8 42.15 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -134.4 77.79 58.91 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 126.173 1.789 . . . . 0.0 110.377 -172.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.42 -8.78 24.52 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.643 2.895 . . . . 0.0 114.997 -168.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -81.58 -9.5 59.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.54 -45.68 24.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.177 0.899 . . . . 0.0 111.848 177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 117.216 2.302 . . . . 0.0 117.216 177.558 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 110.78 -0.082 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -146.17 146.83 30.98 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.411 1.485 . . . . 0.0 111.382 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.3 14.71 80.55 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.3 0.952 . . . . 0.0 115.054 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.5 p -103.61 178.99 4.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.894 2.078 . . . . 0.0 113.134 -175.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.3 m80 62.09 -166.14 0.22 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.355 1.862 . . . . 0.0 113.516 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.1 t60 57.08 54.88 6.48 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.618 1.567 . . . . 0.0 113.209 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.478 ' CG ' ' H ' ' A' ' 8' ' ' HIS . 2.2 t60 -136.75 -174.06 3.61 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.204 1.802 . . . . 0.0 111.21 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.478 ' H ' ' CG ' ' A' ' 7' ' ' HIS . 24.5 m80 58.75 30.96 20.69 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 126.181 1.793 . . . . 0.0 114.789 175.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -62.62 143.07 57.71 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.244 1.018 . . . . 0.0 112.57 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -146.88 156.09 42.82 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.875 1.27 . . . . 0.0 111.812 172.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -176.48 -173.49 42.14 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.699 1.142 . . . . 0.0 113.923 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.6 t 61.99 168.6 0.11 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.307 1.843 . . . . 0.0 114.54 -170.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 63.15 -156.64 41.14 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.574 1.083 . . . . 0.0 113.215 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.97 130.69 35.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.6 0.76 . . . . 0.0 111.538 172.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -83.13 175.98 9.56 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.546 1.138 . . . . 0.0 111.813 174.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.65 138.68 40.88 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -168.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.7 159.12 16.46 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.611 1.565 . . . . 0.0 114.068 172.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.02 149.83 50.68 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.411 1.485 . . . . 0.0 111.538 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -68.85 130.3 42.39 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.311 0.644 . . . . 0.0 109.828 162.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.05 -24.07 17.75 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.26 164.11 31.14 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.363 1.465 . . . . 0.0 112.275 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.98 -167.41 54.67 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 124.179 0.895 . . . . 0.0 114.637 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.44 -28.32 72.59 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 124.114 3.209 . . . . 0.0 114.685 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.0 mt -95.63 2.96 54.39 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.081 1.353 . . . . 0.0 113.536 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.61 127.28 15.34 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.946 0.793 . . . . 0.0 112.396 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.81 -4.65 75.75 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -176.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.5 mt -107.11 155.4 39.35 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 118.932 1.366 . . . . 0.0 112.487 -173.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -55.04 145.5 63.42 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.337 3.358 . . . . 0.0 112.814 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.9 t -81.62 -32.05 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.062 -0.399 . . . . 0.0 110.778 171.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -134.45 167.26 21.08 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.783 1.233 . . . . 0.0 113.487 -175.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.2 mtm180 -62.57 -34.8 77.7 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 121.639 -0.663 . . . . 0.0 111.942 173.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 t -66.16 -42.73 88.6 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.607 0.763 . . . . 0.0 111.243 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -60.2 -46.71 88.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.676 -0.64 . . . . 0.0 110.672 173.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.91 88.63 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.706 0.802 . . . . 0.0 112.394 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -61.95 -42.05 98.67 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.56 1.144 . . . . 0.0 112.041 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 62.0 t -72.81 -35.08 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.336 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.06 -43.99 97.07 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.542 1.519 . . . . 0.0 111.294 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.76 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.529 0.604 . . . . 0.0 110.741 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.22 -50.26 74.35 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.841 0.746 . . . . 0.0 112.195 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -64.0 -38.52 91.38 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.438 0.695 . . . . 0.0 112.265 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.22 -53.79 53.49 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.992 0.917 . . . . 0.0 110.951 173.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 67.9 t90 -54.08 -46.27 72.0 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.264 173.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.76 -45.62 88.99 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.293 0.951 . . . . 0.0 112.39 -173.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -64.09 -49.42 72.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.758 0.823 . . . . 0.0 111.763 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -61.09 -49.15 78.49 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.817 -0.552 . . . . 0.0 111.252 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -56.93 -41.29 77.95 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.111 1.364 . . . . 0.0 112.817 175.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -64.01 -33.67 76.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.605 1.093 . . . . 0.0 112.777 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -77.6 -37.41 50.41 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 172.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -150.11 107.42 3.2 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 128.003 2.521 . . . . 0.0 109.952 -172.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.04 -12.33 23.62 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.338 3.359 . . . . 0.0 117.13 -157.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 21.7 p-90 -69.75 -19.79 63.52 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -172.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 36.1 tp -67.27 138.79 57.13 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -159.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -83.83 148.78 26.8 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.54 1.536 . . . . 0.0 111.72 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 tt -114.91 119.56 36.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.767 1.627 . . . . 0.0 109.15 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -139.12 114.5 9.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.468 1.107 . . . . 0.0 111.487 174.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.66 49.58 1.14 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.0 m -73.62 161.01 30.78 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.736 0.814 . . . . 0.0 110.993 160.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -51.84 -38.25 55.13 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.953 0.901 . . . . 0.0 113.175 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -60.0 -40.85 90.62 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.24 -38.17 89.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.74 -47.02 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.403 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -69.46 -31.79 70.31 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.947 0.794 . . . . 0.0 112.562 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -70.39 -37.2 74.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.841 0.857 . . . . 0.0 113.257 174.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -73.14 -41.22 64.2 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.03 0.832 . . . . 0.0 112.85 171.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.9 82.42 64.23 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.728 1.611 . . . . 0.0 110.156 -165.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -70.07 -10.11 27.56 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.484 2.789 . . . . 0.0 114.589 -167.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -78.52 -10.31 59.67 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.5 -31.64 32.77 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.508 1.049 . . . . 0.0 113.316 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 119.577 1.081 . . . . 0.0 112.728 171.975 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.4 ttp . . . . . 0 N--CA 1.496 1.84 0 N-CA-C 110.864 -0.051 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -126.05 155.15 41.97 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.664 1.586 . . . . 0.0 111.524 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -167.07 6.81 0.05 OUTLIER Glycine 0 CA--C 1.538 1.484 0 N-CA-C 116.779 1.471 . . . . 0.0 116.779 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -89.85 137.02 32.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.158 1.479 . . . . 0.0 112.453 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -145.6 144.68 30.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.573 1.549 . . . . 0.0 111.768 -178.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.0 p-80 -154.72 144.21 21.36 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.137 1.375 . . . . 0.0 111.711 173.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -158.33 146.98 18.87 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.801 1.24 . . . . 0.0 111.327 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -154.31 148.47 25.86 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.964 1.306 . . . . 0.0 111.317 175.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -151.9 164.03 37.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 0.0 113.547 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -131.11 161.89 31.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.977 1.711 . . . . 0.0 112.035 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 85.74 142.19 6.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 124.856 1.217 . . . . 0.0 112.702 -169.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -127.0 4.58 6.5 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -160.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 62.04 28.76 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.988 1.155 . . . . 0.0 115.988 170.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.14 49.5 0.96 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.668 1.587 . . . . 0.0 114.969 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 pp -81.58 -10.34 59.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.6 145.33 56.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.484 1.113 . . . . 0.0 113.438 -177.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.16 151.07 26.95 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.94 149.16 44.62 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.622 1.569 . . . . 0.0 111.964 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -69.08 141.5 54.73 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.85 0.86 . . . . 0.0 110.438 162.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.51 -15.96 14.85 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -172.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.87 159.1 42.94 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.726 1.211 . . . . 0.0 113.158 -170.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.09 -163.57 52.4 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 124.364 0.983 . . . . 0.0 114.44 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.06 -24.35 73.15 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.545 2.83 . . . . 0.0 113.99 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.1 -6.82 59.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.706 1.603 . . . . 0.0 113.625 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.44 16.76 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.68 1.127 . . . . 0.0 111.967 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.36 -0.93 78.75 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 116.102 1.201 . . . . 0.0 116.102 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.59 153.21 41.52 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 119.127 1.464 . . . . 0.0 112.082 -174.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -55.09 143.49 73.74 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.435 3.423 . . . . 0.0 113.492 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.5 t -78.01 -37.8 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.983 -0.448 . . . . 0.0 111.358 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.9 t -139.06 166.1 25.39 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.367 1.467 . . . . 0.0 112.671 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -57.68 -29.44 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.094 -1.004 . . . . 0.0 112.896 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -62.38 -43.07 99.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.572 0.749 . . . . 0.0 111.941 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -64.68 -43.15 94.45 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.565 -0.71 . . . . 0.0 110.259 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.45 -46.83 88.43 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -57.12 -46.9 82.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.02 1.328 . . . . 0.0 111.417 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.4 t -72.69 -32.45 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 118.862 -0.59 . . . . 0.0 112.439 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.7 mt -65.33 -42.38 93.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.179 1.354 . . . . 0.0 111.291 171.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -40.36 88.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 118.732 0.696 . . . . 0.0 110.762 173.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -60.74 -52.04 66.79 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.776 0.716 . . . . 0.0 112.158 174.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -61.78 -39.96 93.51 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.532 0.605 . . . . 0.0 111.807 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -59.38 -54.51 45.89 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.915 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -51.62 -46.32 63.58 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.386 0.994 . . . . 0.0 111.458 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.37 -45.36 84.41 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.879 0.763 . . . . 0.0 111.953 -172.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -70.4 -42.52 71.55 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.37 -0.831 . . . . 0.0 111.927 178.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -58.48 -48.89 79.29 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 121.61 -0.681 . . . . 0.0 110.683 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -63.51 -40.01 95.92 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.516 1.527 . . . . 0.0 112.46 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -65.86 -29.91 70.44 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.865 0.757 . . . . 0.0 112.444 172.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.7 t -79.21 -37.53 37.94 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 171.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -149.04 105.67 3.38 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 127.892 2.477 . . . . 0.0 110.021 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.98 -11.63 25.58 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.648 3.566 . . . . 0.0 117.17 -157.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -69.1 -23.34 64.0 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -173.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 141.78 57.17 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -161.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -98.29 148.12 23.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.052 1.341 . . . . 0.0 111.983 172.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 tt -98.63 118.94 36.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.683 1.593 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -134.54 115.81 14.33 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 111.279 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.99 51.4 0.91 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.439 1.095 . . . . 0.0 113.406 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.4 t -63.89 155.54 30.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.709 160.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -56.98 -29.96 63.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.813 -1.179 . . . . 0.0 112.335 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -60.22 -41.85 93.97 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.424 -0.798 . . . . 0.0 112.53 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.29 86.98 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.679 0.792 . . . . 0.0 111.939 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.46 -48.1 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.514 175.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.88 -33.14 74.95 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.048 0.84 . . . . 0.0 112.288 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -69.3 -39.79 78.07 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.287 1.035 . . . . 0.0 113.002 174.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.0 -37.38 61.84 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -133.07 85.57 45.14 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 110.281 -168.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.84 -16.09 41.13 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.161 2.574 . . . . 0.0 114.619 -166.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 -75.2 -11.68 60.13 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 175.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.91 -26.93 49.36 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.095 0.861 . . . . 0.0 112.31 175.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 . . . . . 0 C--O 1.254 1.328 0 C-N-CA 128.272 2.629 . . . . 0.0 116.757 161.759 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 120.344 0.116 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.0 ptp85 -69.26 164.1 23.51 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.501 1.121 . . . . 0.0 113.415 178.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -161.84 -174.15 31.38 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.925 1.25 . . . . 0.0 113.78 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.8 t -151.96 -58.87 0.15 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.053 1.341 . . . . 0.0 110.748 177.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m80 55.29 29.33 12.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.842 1.657 . . . . 0.0 115.431 166.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -71.68 148.23 46.66 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.986 0.914 . . . . 0.0 112.603 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -147.51 142.39 26.87 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.874 1.67 . . . . 0.0 110.408 172.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -138.02 131.55 30.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.402 1.081 . . . . 0.0 111.902 -175.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -153.97 150.16 28.01 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.811 1.644 . . . . 0.0 110.346 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -152.38 150.85 30.13 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.517 1.127 . . . . 0.0 112.994 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.95 117.51 0.48 Allowed Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.672 1.606 . . . . 0.0 111.012 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -155.58 140.06 16.83 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.177 0.991 . . . . 0.0 112.356 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 74.28 162.38 8.66 Favored Glycine 0 CA--C 1.54 1.64 0 C-N-CA 125.466 1.507 . . . . 0.0 115.694 176.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.96 147.37 22.67 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.357 1.863 . . . . 0.0 110.84 171.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 pp -93.33 -12.97 28.74 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.47 149.36 44.25 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.437 1.095 . . . . 0.0 113.357 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.78 148.26 26.81 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.9 mt -123.75 151.08 43.64 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.86 1.664 . . . . 0.0 111.825 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -69.56 131.68 45.05 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.512 0.725 . . . . 0.0 109.88 161.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.43 -22.55 17.63 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -140.24 162.92 34.12 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.132 1.373 . . . . 0.0 112.647 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.14 -164.45 54.92 Favored Glycine 0 CA--C 1.542 1.771 0 C-N-CA 124.169 0.89 . . . . 0.0 114.463 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.67 -28.94 68.54 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 123.915 3.076 . . . . 0.0 114.646 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 79.9 mt -94.09 1.75 56.11 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.893 1.277 . . . . 0.0 113.542 -176.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.88 125.59 12.23 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.196 0.907 . . . . 0.0 112.268 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.95 -3.39 73.58 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 116.165 1.226 . . . . 0.0 116.165 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.2 mt -107.55 154.9 40.5 Favored Pre-proline 0 CA--C 1.551 1.006 0 CA-C-N 118.977 1.389 . . . . 0.0 112.566 -173.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -56.0 145.26 75.4 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.178 3.252 . . . . 0.0 113.008 176.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -79.18 -28.97 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.252 -0.28 . . . . 0.0 111.398 172.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.5 p -140.94 165.37 27.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.863 1.265 . . . . 0.0 112.262 -174.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -65.02 -27.08 68.56 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.172 -0.955 . . . . 0.0 112.694 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.3 t -69.07 -43.69 74.08 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.339 0.655 . . . . 0.0 111.444 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -61.96 -41.95 98.57 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.247 -0.908 . . . . 0.0 110.908 172.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.64 85.18 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.574 0.749 . . . . 0.0 112.693 176.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.5 -44.91 85.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.99 1.716 . . . . 0.0 111.757 174.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.26 -35.23 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.218 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.69 -45.27 93.56 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.605 1.548 . . . . 0.0 111.314 173.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.2 mt -62.52 -43.45 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 118.272 0.487 . . . . 0.0 110.471 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -59.73 -50.64 73.03 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.878 -0.514 . . . . 0.0 112.342 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -32.69 68.65 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.509 -0.744 . . . . 0.0 111.763 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.45 -48.88 73.63 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.611 0.765 . . . . 0.0 110.918 171.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.2 t90 -55.2 -44.69 75.57 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.788 170.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -65.8 -45.68 81.48 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 120.05 1.296 . . . . 0.0 112.093 -175.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.79 -46.57 88.99 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.945 -0.472 . . . . 0.0 111.695 174.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -58.05 -51.34 70.09 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.069 0.547 . . . . 0.0 111.156 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -53.7 -40.35 65.94 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.526 1.531 . . . . 0.0 111.968 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -68.53 -39.15 81.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.0 m -75.9 -29.36 58.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 175.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -154.2 105.02 2.42 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 128.732 2.813 . . . . 0.0 109.01 -162.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.67 -15.21 24.4 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.452 2.768 . . . . 0.0 116.164 -161.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -71.7 -25.29 62.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.7 tp -69.46 145.89 52.39 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -157.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -107.63 151.69 25.3 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.29 1.836 . . . . 0.0 111.994 172.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.42 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -105.11 119.49 39.17 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.678 1.591 . . . . 0.0 109.879 -176.297 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.79 120.47 18.35 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.609 1.163 . . . . 0.0 111.625 176.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.42 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.92 57.16 0.73 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.732 1.213 . . . . 0.0 112.639 -176.151 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 94.1 p -65.09 160.56 20.81 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.532 163.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -52.45 -39.21 60.8 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.203 -0.936 . . . . 0.0 111.279 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.1 -43.81 98.32 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.313 1.045 . . . . 0.0 112.546 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.76 85.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.665 1.121 . . . . 0.0 112.072 174.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.91 -47.12 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.117 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -68.04 -31.15 70.62 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.704 0.684 . . . . 0.0 112.639 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -71.22 -40.57 71.01 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.632 1.173 . . . . 0.0 112.964 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -73.42 -37.89 65.76 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.843 0.747 . . . . 0.0 112.937 174.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -130.72 85.34 55.99 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.853 1.661 . . . . 0.0 110.076 -168.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -70.41 -8.95 24.82 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.448 2.765 . . . . 0.0 114.852 -168.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -81.24 -9.31 59.8 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.67 -35.09 30.31 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.3 0.954 . . . . 0.0 113.223 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.315 0 CA-C-O 117.426 -1.273 . . . . 0.0 112.645 173.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 mpp? . . . . . 0 N--CA 1.501 2.081 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 48.92 53.67 12.11 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.464 1.506 . . . . 0.0 113.038 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.11 -160.82 10.25 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.748 1.166 . . . . 0.0 114.249 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 t 65.45 152.25 0.06 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.105 2.162 . . . . 0.0 114.856 -169.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -155.77 131.53 9.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.859 1.664 . . . . 0.0 110.83 -174.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -155.51 138.69 15.61 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.329 1.051 . . . . 0.0 112.286 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -142.55 145.89 34.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.199 1.8 . . . . 0.0 111.102 174.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -149.78 161.91 41.3 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.528 1.131 . . . . 0.0 111.99 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 62.52 148.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 128.611 2.764 . . . . 0.0 115.648 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -150.14 26.29 0.79 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.879 1.272 . . . . 0.0 113.51 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.95 -30.11 69.25 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 124.597 1.094 . . . . 0.0 115.37 -174.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 t 42.49 56.08 3.9 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.54 1.936 . . . . 0.0 114.626 167.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -65.61 106.72 1.64 Allowed Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.295 -0.878 . . . . 0.0 114.096 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -103.06 3.9 36.58 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 pp -75.17 -11.08 60.0 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 -170.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.43 142.01 58.32 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.063 0.945 . . . . 0.0 113.359 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.73 154.06 22.04 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.0 mt -125.77 148.81 48.98 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.442 1.497 . . . . 0.0 112.318 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -70.61 142.06 51.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.316 1.047 . . . . 0.0 110.503 163.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.91 -15.99 14.77 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -172.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.0 159.27 42.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.565 1.146 . . . . 0.0 113.07 -170.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.1 -162.91 52.75 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.385 0.993 . . . . 0.0 114.322 177.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.59 -24.18 74.15 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.46 2.773 . . . . 0.0 113.799 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.16 -6.22 59.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.655 1.582 . . . . 0.0 113.699 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.99 125.67 17.97 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.822 1.192 . . . . 0.0 111.99 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.68 -0.56 80.18 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 115.965 1.146 . . . . 0.0 115.965 -177.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.2 mt -106.78 153.38 40.79 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.1 1.45 . . . . 0.0 112.476 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -56.09 142.46 86.07 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.423 3.416 . . . . 0.0 113.07 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 t -77.82 -33.29 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.461 0.305 . . . . 0.0 110.937 173.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.18 164.72 26.72 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.787 1.235 . . . . 0.0 112.709 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.58 -29.19 70.48 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.119 -0.988 . . . . 0.0 112.53 173.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.8 m -68.36 -41.03 81.27 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.704 0.802 . . . . 0.0 111.292 173.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -61.68 -45.64 93.12 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.792 0.723 . . . . 0.0 110.588 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.41 86.28 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.262 0.625 . . . . 0.0 112.488 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -59.92 -42.18 93.37 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.425 1.49 . . . . 0.0 112.089 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.2 t -75.72 -33.12 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.385 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.63 -42.64 99.71 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.737 1.608 . . . . 0.0 111.331 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.5 mt -63.21 -42.78 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 122.991 0.517 . . . . 0.0 110.667 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -59.11 -47.03 86.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.659 0.663 . . . . 0.0 112.425 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -68.39 -37.46 80.39 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 111.998 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -63.17 -50.38 70.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.729 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -53.93 -43.61 69.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.765 1.166 . . . . 0.0 112.468 173.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -56.18 -50.62 70.67 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.971 1.26 . . . . 0.0 111.765 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.59 -48.03 73.7 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 178.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -56.07 -51.35 68.14 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.455 1.102 . . . . 0.0 110.632 176.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -44.25 80.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.463 1.505 . . . . 0.0 111.883 176.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -61.91 -33.88 75.04 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.396 0.998 . . . . 0.0 112.848 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.9 m -78.68 -38.14 40.08 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -152.21 102.97 2.78 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 127.749 2.42 . . . . 0.0 109.659 -169.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.24 -14.08 25.66 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.966 3.111 . . . . 0.0 116.576 -160.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -65.83 -24.18 66.84 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.4 tp -64.62 145.03 56.77 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.78 0.718 . . . . 0.0 112.614 -165.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -102.34 150.28 23.49 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.955 1.302 . . . . 0.0 112.406 172.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.405 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.4 OUTLIER -102.38 115.94 31.6 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 109.497 -176.781 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.59 118.48 16.25 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.467 1.107 . . . . 0.0 111.842 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.405 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -156.12 54.41 0.57 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.592 1.157 . . . . 0.0 113.429 -173.054 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 t -75.07 163.35 27.67 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.594 0.758 . . . . 0.0 111.109 163.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -50.37 -39.45 46.63 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.688 1.195 . . . . 0.0 112.714 -177.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.55 -40.03 93.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.846 0.859 . . . . 0.0 112.719 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.99 88.5 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.517 0.727 . . . . 0.0 111.558 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.01 -46.64 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.346 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -68.0 -33.18 74.13 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.447 0.567 . . . . 0.0 112.342 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.9 ttt-85 -68.37 -41.17 80.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.594 0.758 . . . . 0.0 112.393 174.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.6 mtt-85 -73.44 -37.7 65.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.859 0.864 . . . . 0.0 112.785 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -134.55 88.0 30.33 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.976 1.71 . . . . 0.0 110.33 -170.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.22 -14.54 37.98 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.177 2.585 . . . . 0.0 114.672 -167.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -78.48 -6.87 56.6 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 177.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -86.1 -30.13 22.8 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 . . . . . 0 C--O 1.255 1.39 0 CA-C-N 119.342 0.974 . . . . 0.0 113.098 178.369 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttm . . . . . 0 N--CA 1.497 1.921 0 CA-C-O 119.604 -0.236 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -84.38 -34.48 23.58 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.661 0.784 . . . . 0.0 112.936 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.76 162.35 14.52 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.839 1.209 . . . . 0.0 113.619 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 t -157.09 175.76 13.65 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.375 1.07 . . . . 0.0 112.498 -177.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.6 m80 57.97 110.78 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.938 2.895 . . . . 0.0 115.156 177.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -137.54 146.92 44.71 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.901 1.281 . . . . 0.0 111.838 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -155.34 -173.46 4.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.899 1.68 . . . . 0.0 111.394 -175.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.2 p-80 -140.73 145.3 36.26 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.245 1.018 . . . . 0.0 113.029 172.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -142.86 173.12 11.83 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.817 2.047 . . . . 0.0 111.247 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 64.26 -178.88 0.17 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.367 1.867 . . . . 0.0 114.706 173.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -173.58 -179.52 44.29 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.133 0.873 . . . . 0.0 114.285 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.0 p -67.02 152.6 45.49 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.68 1.192 . . . . 0.0 113.114 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.33 -11.23 31.8 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.782 1.182 . . . . 0.0 115.429 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -132.39 18.54 4.39 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.118 1.767 . . . . 0.0 113.174 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.81 165.04 24.66 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.186 1.395 . . . . 0.0 112.028 -177.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.85 145.43 29.67 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -171.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.23 154.33 31.35 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.663 1.585 . . . . 0.0 113.88 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -121.81 149.58 43.13 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.457 1.503 . . . . 0.0 111.851 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -68.33 141.14 55.89 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.911 0.884 . . . . 0.0 110.487 162.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.14 -16.69 15.17 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.14 159.85 41.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.616 1.166 . . . . 0.0 112.862 -170.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.77 -164.39 53.23 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 124.248 0.928 . . . . 0.0 114.419 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.71 -24.05 74.09 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.489 2.793 . . . . 0.0 113.943 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.37 -6.14 59.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.749 1.62 . . . . 0.0 113.691 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.66 126.04 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.825 1.193 . . . . 0.0 112.037 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.22 -1.61 80.1 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 115.987 1.155 . . . . 0.0 115.987 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.8 mt -107.28 153.32 41.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 119.063 1.431 . . . . 0.0 112.238 -174.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -56.97 144.31 89.73 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 124.315 3.343 . . . . 0.0 113.043 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.7 t -78.61 -36.12 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.596 0.358 . . . . 0.0 111.493 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.5 t -140.98 166.12 25.66 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.402 1.481 . . . . 0.0 112.838 176.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -57.21 -28.96 63.32 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.409 1.484 . . . . 0.0 113.365 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.4 t -63.99 -42.07 97.32 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.371 0.668 . . . . 0.0 111.94 171.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -65.46 -45.04 85.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.173 -0.954 . . . . 0.0 110.326 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.9 89.15 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.639 0.654 . . . . 0.0 112.396 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -60.29 -47.7 84.89 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 0.0 111.676 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 74.1 t -69.35 -34.27 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.388 -0.82 . . . . 0.0 112.277 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.6 -43.65 93.11 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.505 1.502 . . . . 0.0 111.701 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.5 mt -68.0 -37.4 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 118.622 0.646 . . . . 0.0 110.893 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.93 -49.64 76.89 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.772 0.714 . . . . 0.0 111.993 171.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.78 -39.78 90.11 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.787 0.835 . . . . 0.0 111.788 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.49 -57.73 11.49 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.853 -1.07 . . . . 0.0 111.319 171.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 60.1 t90 -52.6 -46.75 67.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.127 1.33 . . . . 0.0 112.038 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -65.37 -43.32 91.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.035 0.934 . . . . 0.0 112.302 -174.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.43 -47.94 71.57 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.578 -0.701 . . . . 0.0 111.886 175.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -59.82 -44.79 93.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.57 0.748 . . . . 0.0 110.469 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.65 -35.75 80.63 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.983 1.313 . . . . 0.0 112.474 176.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -63.78 -39.08 93.4 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.341 0.973 . . . . 0.0 112.808 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -75.58 -36.27 60.39 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 175.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -149.92 103.4 3.2 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 127.637 2.375 . . . . 0.0 109.488 -170.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 -12.52 27.02 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.187 3.258 . . . . 0.0 116.632 -159.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.9 p-90 -68.93 -23.03 64.12 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.16 132.44 50.41 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -160.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -85.01 133.02 34.26 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.192 1.397 . . . . 0.0 110.601 170.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.8 tt -79.44 118.12 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.961 0.904 . . . . 0.0 108.72 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -122.07 115.38 22.38 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.49 0.716 . . . . 0.0 111.364 171.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.9 142.3 18.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.448 1.118 . . . . 0.0 112.968 164.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -152.1 171.62 17.6 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.766 2.827 . . . . 0.0 107.169 166.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -53.98 -34.1 58.86 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.612 -1.305 . . . . 0.0 112.96 -176.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.705 0.802 . . . . 0.0 112.848 171.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.5 87.74 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.851 0.861 . . . . 0.0 111.902 174.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.67 -44.93 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.132 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -67.92 -34.81 77.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.316 0.507 . . . . 0.0 112.069 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -65.18 -43.79 90.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.15 0.98 . . . . 0.0 112.176 175.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -74.79 -40.91 60.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.392 0.677 . . . . 0.0 112.328 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -125.99 90.28 50.6 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.859 1.664 . . . . 0.0 110.39 -172.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.04 -15.87 40.14 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.07 2.513 . . . . 0.0 114.696 -166.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -79.91 -6.89 58.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.51 -28.78 26.48 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--O 1.254 1.299 0 CA-C-N 119.202 0.91 . . . . 0.0 112.86 177.603 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.9 mtm . . . . . 0 N--CA 1.499 1.977 0 CA-C-O 120.221 0.058 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 155.55 35.58 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.978 0.911 . . . . 0.0 112.735 176.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.55 -169.42 37.37 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.102 0.858 . . . . 0.0 113.692 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 m -101.52 -43.27 5.95 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.378 1.071 . . . . 0.0 112.669 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -149.65 23.95 0.88 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.103 1.361 . . . . 0.0 112.182 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -101.09 -8.16 22.55 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 -157.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -130.65 141.37 50.42 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.977 1.311 . . . . 0.0 112.178 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -156.64 167.46 30.38 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.91 1.684 . . . . 0.0 111.879 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.5 p80 -146.1 151.63 38.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.151 1.381 . . . . 0.0 112.028 174.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -158.36 179.76 8.85 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.119 1.367 . . . . 0.0 112.295 -177.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 87.91 163.43 39.12 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 125.586 1.565 . . . . 0.0 116.0 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -154.04 150.62 28.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.981 1.712 . . . . 0.0 111.762 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -122.96 14.26 8.45 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 125.936 1.731 . . . . 0.0 114.715 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.25 -5.32 26.84 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 116.053 1.872 . . . . 0.0 116.053 -165.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.5 tp -69.64 -31.05 68.92 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.883 1.273 . . . . 0.0 112.454 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -87.36 147.95 25.24 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.706 0.802 . . . . 0.0 112.991 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.53 24.97 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 176.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.67 149.97 50.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.627 1.571 . . . . 0.0 111.815 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.77 129.62 40.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.908 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.44 -17.56 22.37 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -173.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.01 167.22 27.35 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.944 1.298 . . . . 0.0 112.942 -173.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.84 -165.95 54.74 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 124.032 0.825 . . . . 0.0 114.417 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -56.06 -28.41 69.47 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.982 3.121 . . . . 0.0 114.631 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.39 3.22 54.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 0.0 113.458 -176.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.3 125.83 11.76 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.141 0.882 . . . . 0.0 112.37 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.22 -3.27 76.1 Favored Glycine 0 CA--C 1.53 0.983 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -177.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 36.4 mt -106.14 155.27 38.8 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 119.01 1.405 . . . . 0.0 112.452 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -54.53 143.83 65.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.313 3.342 . . . . 0.0 112.585 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.8 t -78.15 -32.29 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 122.121 -0.362 . . . . 0.0 110.785 170.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -135.52 165.12 26.25 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.503 1.121 . . . . 0.0 113.422 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -58.75 -32.01 68.86 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.581 0.752 . . . . 0.0 112.821 171.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.5 m -71.17 -40.66 71.13 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.935 0.894 . . . . 0.0 111.704 174.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -62.07 -43.87 97.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.787 0.721 . . . . 0.0 110.561 172.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.83 -48.27 82.34 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.402 0.681 . . . . 0.0 111.991 177.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.4 ttm-85 -56.58 -46.07 80.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.856 1.262 . . . . 0.0 111.935 175.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 69.1 t -73.47 -34.15 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.08 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.85 -44.84 88.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 120.524 1.511 . . . . 0.0 111.427 173.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -62.18 -42.69 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.175 0.59 . . . . 0.0 110.338 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -60.93 -52.14 66.3 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -63.21 -39.6 95.09 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.332 0.653 . . . . 0.0 111.696 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.89 -52.84 63.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.144 0.578 . . . . 0.0 111.004 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -55.16 -41.53 71.96 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.18 0.9 . . . . 0.0 112.864 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -65.43 -45.03 85.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.687 1.131 . . . . 0.0 111.878 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -65.99 -43.9 86.42 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.304 -0.872 . . . . 0.0 112.336 175.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.98 -48.29 82.11 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.058 0.543 . . . . 0.0 110.491 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -59.14 -33.55 71.02 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.519 1.128 . . . . 0.0 112.166 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.67 -44.67 93.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.919 0.888 . . . . 0.0 112.985 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.1 p -86.02 -28.38 24.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -151.48 103.14 2.91 Favored Pre-proline 0 CA--C 1.557 1.226 0 C-N-CA 128.693 2.797 . . . . 0.0 109.832 -176.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.84 -13.74 24.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.94 3.093 . . . . 0.0 116.767 -160.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -67.28 -24.1 65.74 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -171.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.78 144.85 56.72 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -161.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -96.69 149.89 21.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.251 1.42 . . . . 0.0 113.167 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.19 118.4 36.44 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.785 1.634 . . . . 0.0 109.213 -178.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -131.53 110.61 11.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.235 1.014 . . . . 0.0 112.07 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.08 55.2 0.99 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.193 1.397 . . . . 0.0 112.674 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 92.5 p -62.14 154.96 25.65 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.169 156.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.05 -32.09 70.59 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.48 -1.387 . . . . 0.0 111.284 178.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -57.33 -43.73 83.61 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.578 1.151 . . . . 0.0 112.457 167.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.77 76.84 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.32 0.648 . . . . 0.0 112.652 174.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.28 -48.77 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 174.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.32 -29.53 69.12 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.437 0.562 . . . . 0.0 112.258 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -70.3 -45.19 66.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.602 1.161 . . . . 0.0 112.536 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -69.85 -37.41 76.14 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 118.658 0.663 . . . . 0.0 112.749 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -130.77 84.62 58.04 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.862 1.665 . . . . 0.0 110.475 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.25 -12.86 34.85 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.307 2.671 . . . . 0.0 114.571 -168.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -76.49 -11.56 59.9 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.21 -26.66 35.74 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 119.177 0.898 . . . . 0.0 112.818 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 128.03 2.532 . . . . 0.0 116.488 167.316 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mtp . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 119.233 -0.413 . . . . 0.0 111.33 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -73.2 149.66 42.7 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.367 1.067 . . . . 0.0 111.696 177.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -163.06 175.08 39.43 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.935 1.255 . . . . 0.0 113.277 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 t -86.24 156.88 20.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.538 1.135 . . . . 0.0 112.604 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -137.35 155.62 49.19 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.961 1.705 . . . . 0.0 111.792 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.6 p-80 -139.66 149.49 43.79 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.028 1.331 . . . . 0.0 112.144 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.507 ' CG ' ' H ' ' A' ' 8' ' ' HIS . 1.9 t60 -154.8 -168.41 2.89 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.901 1.68 . . . . 0.0 110.501 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . 0.507 ' H ' ' CG ' ' A' ' 7' ' ' HIS . 86.7 m-70 57.13 75.11 0.38 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.829 2.052 . . . . 0.0 114.164 169.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.5 m80 -77.83 40.36 0.31 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.42 1.488 . . . . 0.0 113.031 177.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.91 163.45 12.2 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.529 1.932 . . . . 0.0 113.183 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -174.4 172.62 45.53 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.515 1.055 . . . . 0.0 113.638 175.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.5 p -146.31 158.61 43.9 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -175.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -79.44 173.0 55.2 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.316 0.96 . . . . 0.0 113.553 172.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.66 53.76 1.39 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.375 1.47 . . . . 0.0 113.04 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.5 mt -75.12 -24.78 58.08 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.225 1.01 . . . . 0.0 113.485 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.58 145.67 54.65 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.72 153.92 32.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.419 1.488 . . . . 0.0 114.122 171.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.42 149.88 43.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.633 1.573 . . . . 0.0 111.796 -178.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -69.05 141.43 54.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.897 0.879 . . . . 0.0 110.265 163.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.77 -17.71 15.46 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.33 160.22 40.33 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.645 1.178 . . . . 0.0 113.074 -170.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.04 -164.11 53.76 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 124.484 1.04 . . . . 0.0 114.45 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.79 -24.11 74.58 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.61 2.873 . . . . 0.0 113.812 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -6.17 59.35 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.759 1.624 . . . . 0.0 113.607 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.41 126.22 18.61 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.718 1.145 . . . . 0.0 112.23 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 -1.11 81.26 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -108.12 152.78 41.96 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-N 119.045 1.423 . . . . 0.0 112.363 -173.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.24 144.2 91.47 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 124.387 3.391 . . . . 0.0 113.23 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.8 t -80.48 -37.39 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 122.871 0.468 . . . . 0.0 111.537 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -139.05 168.92 18.76 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.356 1.462 . . . . 0.0 113.172 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -58.21 -35.06 71.09 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.753 1.221 . . . . 0.0 111.446 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -61.0 -39.95 91.66 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.264 1.026 . . . . 0.0 112.503 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -67.11 -47.01 72.42 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.534 -0.729 . . . . 0.0 110.005 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.19 -42.4 90.8 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.734 0.697 . . . . 0.0 112.524 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -58.96 -49.03 79.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.059 1.743 . . . . 0.0 111.703 172.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.11 -35.44 63.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-O 118.632 -0.699 . . . . 0.0 112.346 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.0 -48.64 79.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.069 1.304 . . . . 0.0 110.947 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.4 mt -63.01 -41.05 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.757 0.708 . . . . 0.0 110.94 176.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -55.14 37.74 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 122.957 0.503 . . . . 0.0 110.974 176.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -65.29 -36.03 82.83 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.828 -1.17 . . . . 0.0 112.682 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -56.85 -55.61 32.24 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.211 1.004 . . . . 0.0 110.935 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 56.3 t90 -51.85 -43.36 63.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.756 169.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -64.52 -46.93 80.8 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.731 1.15 . . . . 0.0 112.211 -173.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.03 -41.08 82.67 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.341 -0.849 . . . . 0.0 111.725 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.95 -50.46 73.98 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.581 -0.699 . . . . 0.0 111.098 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? -58.09 -39.9 79.76 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.607 1.963 . . . . 0.0 112.702 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -64.69 -35.79 82.17 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 118.899 0.772 . . . . 0.0 112.423 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.5 t -77.05 -37.57 54.41 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 174.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -150.52 106.98 3.11 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 128.127 2.571 . . . . 0.0 109.796 -172.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.55 -12.59 22.53 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.463 3.442 . . . . 0.0 116.919 -159.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -66.05 -25.02 66.85 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -174.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.1 tp -66.5 142.85 57.4 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -164.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -104.19 143.58 32.75 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.041 1.336 . . . . 0.0 111.949 175.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.423 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -93.64 119.84 33.15 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.226 1.41 . . . . 0.0 109.78 -178.561 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -135.1 120.62 19.27 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.551 1.141 . . . . 0.0 111.609 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.423 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.01 52.17 0.8 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.72 1.208 . . . . 0.0 112.876 -176.153 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.7 m -68.02 161.29 27.01 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.267 164.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -52.15 -38.52 57.84 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.991 -1.068 . . . . 0.0 113.075 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.73 -39.07 90.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.068 0.947 . . . . 0.0 112.787 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.1 -39.32 89.89 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.828 0.74 . . . . 0.0 111.485 174.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.26 -46.07 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.51 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.26 -30.09 67.05 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.479 0.581 . . . . 0.0 112.424 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -71.42 -40.24 70.56 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.748 0.819 . . . . 0.0 112.509 173.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 28.6 mmm-85 -68.93 -41.46 78.08 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.841 0.856 . . . . 0.0 112.127 173.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -136.38 90.57 17.48 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.576 1.55 . . . . 0.0 110.616 -168.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.13 -16.31 40.12 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.072 2.515 . . . . 0.0 114.795 -167.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -78.46 -6.51 55.54 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -85.95 -24.58 26.48 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 C--O 1.252 1.205 0 CA-C-N 119.76 1.164 . . . . 0.0 112.542 179.262 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ptt? . . . . . 0 N--CA 1.498 1.931 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -136.9 -48.91 0.62 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.773 1.229 . . . . 0.0 113.426 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.3 -172.0 43.02 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.883 1.23 . . . . 0.0 113.207 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.6 m -128.88 145.26 51.26 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.024 1.33 . . . . 0.0 112.112 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -140.57 162.6 34.99 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.706 1.603 . . . . 0.0 112.026 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -123.21 151.31 42.38 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.981 1.313 . . . . 0.0 111.987 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -134.31 17.79 3.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.162 1.385 . . . . 0.0 114.124 -168.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -83.7 120.08 25.56 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.415 -0.803 . . . . 0.0 112.64 -175.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -158.65 164.41 36.0 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.573 1.949 . . . . 0.0 110.806 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -117.03 -65.9 1.14 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.244 1.018 . . . . 0.0 111.121 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.71 -170.26 32.54 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.47 1.033 . . . . 0.0 115.525 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.4 m 56.19 23.41 7.0 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.422 1.889 . . . . 0.0 115.694 174.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -86.25 -1.08 86.52 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.834 1.094 . . . . 0.0 115.834 -174.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -147.11 169.88 18.35 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.003 1.321 . . . . 0.0 113.684 -172.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 pp -136.36 155.04 50.61 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.781 2.032 . . . . 0.0 113.778 -175.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.15 151.68 33.51 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.061 0.944 . . . . 0.0 113.015 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.72 156.19 29.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.568 1.547 . . . . 0.0 114.262 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -128.81 149.87 50.55 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.579 1.552 . . . . 0.0 112.069 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -69.82 132.32 45.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.978 0.911 . . . . 0.0 109.977 163.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.12 -24.34 16.9 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -175.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.11 163.85 31.86 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.072 1.349 . . . . 0.0 112.519 -171.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.18 -166.21 54.77 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.08 0.847 . . . . 0.0 114.494 176.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.99 -28.7 70.3 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.043 3.162 . . . . 0.0 114.634 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.2 mt -94.93 2.8 55.44 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.981 1.312 . . . . 0.0 113.478 -176.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.77 126.68 14.41 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.198 0.908 . . . . 0.0 112.328 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.89 -3.4 77.48 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.5 mt -107.59 155.17 40.16 Favored Pre-proline 0 CA--C 1.552 1.042 0 CA-C-N 119.068 1.434 . . . . 0.0 112.599 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -55.34 144.07 73.59 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 124.333 3.355 . . . . 0.0 112.945 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.89 -32.95 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 122.147 -0.346 . . . . 0.0 110.848 172.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.0 p -133.37 164.11 27.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.899 1.28 . . . . 0.0 112.75 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -65.79 -25.78 67.4 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.912 -1.117 . . . . 0.0 112.843 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.8 t -68.27 -44.05 76.41 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.351 0.66 . . . . 0.0 111.098 170.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -59.17 -43.96 92.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.69 0.677 . . . . 0.0 110.643 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.63 84.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.495 0.718 . . . . 0.0 112.638 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -58.44 -43.82 88.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.127 0.971 . . . . 0.0 111.903 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.1 t -73.86 -31.9 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.523 179.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.7 mt -65.75 -42.57 90.75 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.659 1.572 . . . . 0.0 111.472 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -63.22 -41.79 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 118.52 0.6 . . . . 0.0 110.505 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -60.11 -50.16 74.78 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.76 -0.587 . . . . 0.0 112.312 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.83 -36.76 83.09 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 118.77 0.714 . . . . 0.0 111.952 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -59.51 -54.07 50.85 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.702 169.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -52.07 -43.65 63.95 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 119.218 0.917 . . . . 0.0 111.886 173.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.17 -48.67 79.02 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.834 0.853 . . . . 0.0 111.592 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.13 -44.59 79.45 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.539 -0.726 . . . . 0.0 112.335 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -57.33 -50.0 74.34 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.394 0.678 . . . . 0.0 110.363 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.52 -41.22 89.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.849 1.66 . . . . 0.0 112.333 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.12 -33.08 74.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.612 0.765 . . . . 0.0 112.529 174.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.5 m -82.19 -35.41 28.35 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -151.14 102.81 2.98 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 127.746 2.418 . . . . 0.0 109.732 -168.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.57 -12.8 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.241 3.294 . . . . 0.0 116.781 -158.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.2 p-90 -66.33 -25.4 66.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -172.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.0 tp -67.65 145.54 54.72 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -161.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -101.75 149.47 24.13 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.458 1.503 . . . . 0.0 112.47 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.87 116.31 32.42 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.793 1.637 . . . . 0.0 109.191 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.51 117.63 15.44 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.637 1.175 . . . . 0.0 111.309 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.59 51.19 0.76 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -66.94 159.58 28.15 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.235 0.614 . . . . 0.0 111.289 163.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -50.35 -38.37 41.81 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.809 1.244 . . . . 0.0 112.335 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -62.36 -39.26 92.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.121 0.969 . . . . 0.0 113.018 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.22 85.86 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.525 0.73 . . . . 0.0 111.611 173.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.65 -48.02 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.211 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -67.01 -31.07 71.38 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.8 0.727 . . . . 0.0 112.212 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -68.65 -42.24 78.24 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.134 0.974 . . . . 0.0 112.787 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -71.72 -42.83 66.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -130.68 81.24 68.1 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.04 1.736 . . . . 0.0 109.96 -163.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.14 -14.37 40.54 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.198 2.599 . . . . 0.0 114.528 -167.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 34.8 p-80 -74.95 -10.36 59.41 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.21 -26.87 28.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.471 1.032 . . . . 0.0 113.734 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.23 0 CA-C-N 119.231 0.923 . . . . 0.0 111.587 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 tmm? . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -141.94 79.52 1.68 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.157 1.383 . . . . 0.0 111.063 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.99 159.14 52.61 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.351 0.976 . . . . 0.0 113.276 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -72.24 -37.48 69.13 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.425 0.69 . . . . 0.0 112.428 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -150.72 150.6 31.25 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.871 1.668 . . . . 0.0 111.246 173.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -148.21 142.55 26.26 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.595 1.158 . . . . 0.0 111.54 171.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -82.6 84.54 7.23 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.026 0.93 . . . . 0.0 110.046 170.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -74.15 -22.81 59.28 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -65.56 149.26 50.36 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.872 1.269 . . . . 0.0 112.247 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -152.87 136.03 15.67 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.315 1.046 . . . . 0.0 111.676 177.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 67.08 178.29 10.21 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 124.35 0.976 . . . . 0.0 114.224 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -160.93 158.08 27.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.873 1.269 . . . . 0.0 111.758 172.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 178.21 157.74 19.54 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.399 1.0 . . . . 0.0 113.787 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -88.77 33.71 0.77 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.73 1.612 . . . . 0.0 113.505 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 pp -76.01 -13.47 60.23 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -170.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.84 136.15 53.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.559 0.743 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.88 153.0 21.95 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -124.59 148.7 47.7 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.404 1.481 . . . . 0.0 112.021 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -69.88 141.6 53.14 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 110.327 162.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.62 -13.3 15.08 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -172.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.51 158.15 44.82 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.679 1.191 . . . . 0.0 112.893 -171.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.25 -163.0 51.45 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.431 1.015 . . . . 0.0 114.487 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.37 -24.09 73.04 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.522 2.814 . . . . 0.0 113.952 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.63 -7.13 59.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.647 1.579 . . . . 0.0 113.647 178.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.77 125.14 15.87 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.806 1.185 . . . . 0.0 112.027 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.2 -1.21 76.67 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 116.117 1.207 . . . . 0.0 116.117 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.0 mt -106.84 152.81 41.0 Favored Pre-proline 0 CA--C 1.549 0.938 0 CA-C-N 119.07 1.435 . . . . 0.0 112.452 -174.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -55.26 142.84 77.99 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 124.471 3.447 . . . . 0.0 112.866 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.3 t -78.02 -33.61 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.746 172.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.8 p -133.38 164.67 26.59 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.649 1.18 . . . . 0.0 113.185 -175.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -32.77 70.25 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.314 -0.866 . . . . 0.0 112.337 172.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -71.41 -38.7 71.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.929 0.892 . . . . 0.0 111.656 176.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -61.68 -45.22 94.92 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.826 0.739 . . . . 0.0 110.341 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.85 -46.84 89.0 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.223 0.609 . . . . 0.0 112.273 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -57.16 -44.8 83.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.145 1.378 . . . . 0.0 112.001 175.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.0 t -76.57 -32.34 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-O 118.563 -0.732 . . . . 0.0 112.29 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.8 mt -62.57 -44.16 97.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.417 1.462 . . . . 0.0 111.067 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.13 -40.8 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 118.658 0.663 . . . . 0.0 111.026 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -61.36 -48.64 80.36 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.68 -0.637 . . . . 0.0 112.314 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -65.17 -39.61 93.14 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.722 0.692 . . . . 0.0 111.909 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -55.87 -56.64 18.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.755 1.222 . . . . 0.0 110.667 173.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -51.44 -47.11 63.17 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 118.317 -0.849 . . . . 0.0 112.45 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.6 -47.82 79.88 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.879 1.218 . . . . 0.0 112.375 -173.216 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.0 -43.8 86.67 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.526 -0.734 . . . . 0.0 111.812 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -58.55 -52.96 63.42 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.844 -0.535 . . . . 0.0 110.998 175.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.3 tmtt? -54.73 -41.84 70.86 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.107 1.763 . . . . 0.0 112.613 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -67.6 -32.44 73.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.864 0.757 . . . . 0.0 112.806 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.3 t -78.07 -38.48 44.2 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 173.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -154.28 109.34 2.43 Favored Pre-proline 0 CA--C 1.554 1.108 0 C-N-CA 129.099 2.96 . . . . 0.0 109.482 -172.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.45 -13.72 22.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.182 3.255 . . . . 0.0 116.727 -160.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -67.43 -21.81 65.55 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.24 132.67 45.29 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.331 0.969 . . . . 0.0 110.81 -167.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -96.43 134.73 39.23 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.787 1.235 . . . . 0.0 112.413 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.411 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -83.16 119.14 24.15 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.88 1.272 . . . . 0.0 110.117 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -137.07 121.33 18.03 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.832 1.253 . . . . 0.0 111.579 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.411 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.2 55.55 0.76 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.638 1.175 . . . . 0.0 113.19 -177.886 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.9 t -63.82 153.27 37.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.464 158.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -54.9 -31.25 59.83 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.064 -1.022 . . . . 0.0 112.261 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.55 -41.5 94.64 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.871 0.869 . . . . 0.0 112.604 171.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.0 -37.64 88.34 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.776 0.83 . . . . 0.0 111.76 173.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -48.89 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.348 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -67.93 -30.46 69.78 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.688 0.677 . . . . 0.0 112.247 -178.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.56 -45.03 76.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.208 1.003 . . . . 0.0 112.379 172.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -71.81 -36.09 70.15 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.427 0.691 . . . . 0.0 112.771 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -133.02 84.74 47.89 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.919 1.688 . . . . 0.0 110.506 -169.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 -9.13 24.2 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.397 2.731 . . . . 0.0 114.979 -167.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 32.8 p-80 -81.44 -7.39 59.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.69 -36.97 28.1 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.273 0.942 . . . . 0.0 113.122 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.293 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.736 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 118.942 -0.551 . . . . 0.0 111.493 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -80.28 148.42 30.75 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.373 0.988 . . . . 0.0 111.378 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.43 -23.49 65.18 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.296 0.95 . . . . 0.0 114.899 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.7 m -83.44 42.93 0.86 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.55 1.54 . . . . 0.0 113.115 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -147.57 165.34 30.65 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.999 1.72 . . . . 0.0 111.984 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 57.99 28.05 15.68 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.13 1.772 . . . . 0.0 114.073 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -90.94 -8.92 47.95 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.627 1.971 . . . . 0.0 114.486 -175.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -112.31 135.33 53.13 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.394 1.478 . . . . 0.0 111.887 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -141.04 142.17 34.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 111.595 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -152.38 -173.12 4.44 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.066 1.347 . . . . 0.0 112.008 -178.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.27 157.13 15.84 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 123.943 0.783 . . . . 0.0 114.394 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.1 p -146.62 -29.5 0.38 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.99 156.9 12.88 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 124.643 1.116 . . . . 0.0 114.662 -179.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.98 44.45 1.13 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.548 . . . . 0.0 113.729 -171.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.2 pp -78.32 -14.06 59.58 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.3 51.89 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.018 0.927 . . . . 0.0 112.918 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -105.75 153.06 22.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.887 1.44 . . . . 0.0 114.887 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.9 mt -127.9 149.94 50.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.675 1.59 . . . . 0.0 111.977 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -70.19 131.04 43.63 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.602 0.761 . . . . 0.0 109.848 162.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.5 -25.18 17.71 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -175.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.36 164.55 29.95 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.307 1.443 . . . . 0.0 112.438 -171.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.29 -165.47 54.57 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.157 0.884 . . . . 0.0 114.542 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.33 -28.51 72.5 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 124.066 3.178 . . . . 0.0 114.648 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.0 mt -95.9 3.49 53.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.002 1.321 . . . . 0.0 113.519 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.37 126.03 12.3 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.098 0.863 . . . . 0.0 112.45 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.0 -2.96 76.58 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.79 1.186 . . . . 0.0 116.013 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.7 mt -107.49 154.66 40.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 CA-C-N 118.996 1.398 . . . . 0.0 112.657 -172.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -54.98 143.72 71.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.574 3.516 . . . . 0.0 112.925 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -79.05 -32.56 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.077 -0.389 . . . . 0.0 111.009 172.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -133.77 164.36 27.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.862 1.265 . . . . 0.0 112.491 -176.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.62 -26.58 68.46 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.914 -1.116 . . . . 0.0 112.808 172.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.2 t -68.19 -42.32 80.09 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.278 0.631 . . . . 0.0 111.169 171.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -61.25 -44.34 97.41 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.306 -0.871 . . . . 0.0 110.814 172.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.52 -47.16 87.39 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.371 0.668 . . . . 0.0 112.437 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.5 ttt-85 -58.09 -45.92 86.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.307 1.443 . . . . 0.0 111.833 175.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -74.2 -33.7 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.297 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.42 -46.34 88.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.235 1.38 . . . . 0.0 111.192 171.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 82.4 mt -61.55 -43.41 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.461 0.573 . . . . 0.0 110.798 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.62 -51.81 67.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.577 0.751 . . . . 0.0 112.267 177.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -69.09 -34.51 75.23 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.137 -0.977 . . . . 0.0 112.198 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -62.81 -50.87 69.29 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.374 0.67 . . . . 0.0 111.395 171.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 58.2 t90 -51.65 -44.58 63.05 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.043 0.838 . . . . 0.0 111.638 170.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.12 -46.38 87.55 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.396 0.998 . . . . 0.0 111.6 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -60.86 -47.99 83.85 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.566 0.747 . . . . 0.0 112.459 174.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -60.62 -51.34 69.83 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.573 -0.704 . . . . 0.0 111.201 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -62.32 -31.92 72.61 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.271 1.428 . . . . 0.0 112.914 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.5 tptt -60.96 -45.68 93.78 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.7 1.137 . . . . 0.0 112.345 165.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.1 t -77.7 -35.41 52.17 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -147.78 105.79 3.7 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 128.666 2.786 . . . . 0.0 108.946 -172.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.24 -14.28 25.66 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.901 3.067 . . . . 0.0 116.732 -157.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -68.47 -24.05 64.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -171.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.7 tp -68.66 140.4 55.46 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -98.13 153.95 18.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.92 1.288 . . . . 0.0 112.928 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.407 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -101.09 118.53 37.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.912 1.685 . . . . 0.0 109.329 178.539 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -135.93 119.44 16.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.492 1.117 . . . . 0.0 111.323 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' MET . . . . . 0.407 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.67 52.04 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.456 1.122 . . . . 0.0 113.377 -173.893 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.5 m -67.64 159.45 29.93 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.298 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -53.46 -37.0 62.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.094 -1.003 . . . . 0.0 112.596 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -61.86 -38.73 89.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.684 0.794 . . . . 0.0 113.06 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.59 91.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.994 0.815 . . . . 0.0 111.036 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.35 -47.69 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 119.177 -0.44 . . . . 0.0 110.464 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -67.97 -31.14 70.64 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.632 0.651 . . . . 0.0 112.568 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -70.12 -40.7 74.7 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.452 -0.78 . . . . 0.0 112.667 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -77.1 -33.49 56.93 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -133.41 83.65 48.93 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.923 1.689 . . . . 0.0 110.338 -171.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.43 -12.68 34.07 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.253 2.635 . . . . 0.0 114.563 -169.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -77.49 -7.19 55.84 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.74 -30.49 21.59 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.281 0.946 . . . . 0.0 113.41 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.227 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.56 153.86 21.72 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.1 mt -125.62 149.31 48.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.405 1.482 . . . . 0.0 112.06 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.85 142.01 53.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.878 0.871 . . . . 0.0 110.557 164.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.88 -8.47 15.96 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.14 161.85 40.04 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.29 1.036 . . . . 0.0 113.548 -173.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.05 -164.82 49.66 Favored Glycine 0 CA--C 1.542 1.75 0 C-N-CA 124.3 0.952 . . . . 0.0 114.378 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.78 -24.32 71.05 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.582 2.855 . . . . 0.0 113.85 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.43 -8.09 59.63 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.907 1.683 . . . . 0.0 113.861 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.47 125.67 16.99 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.654 1.116 . . . . 0.0 111.971 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.64 -1.25 78.43 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 116.189 1.236 . . . . 0.0 116.189 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.2 mt -107.37 153.9 40.95 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.02 1.41 . . . . 0.0 112.292 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -55.6 143.15 80.23 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.231 3.287 . . . . 0.0 113.193 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -79.45 -33.39 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 122.412 0.285 . . . . 0.0 111.002 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -133.31 165.36 25.0 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.3 mtt85 -52.78 -42.19 64.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.842 1.257 . . . . 0.0 111.397 170.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.4 m -71.52 -36.76 71.15 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.838 0.855 . . . . 0.0 113.116 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -61.62 -43.94 97.92 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.917 1.235 . . . . 0.0 110.502 171.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.42 -47.61 83.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.318 0.647 . . . . 0.0 112.447 178.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -55.18 -46.47 75.8 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.096 1.358 . . . . 0.0 111.845 174.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.0 t -77.29 -31.49 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 118.404 -0.808 . . . . 0.0 112.27 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.1 mt -63.43 -43.57 97.05 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.491 1.496 . . . . 0.0 111.444 169.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.9 mt -63.43 -42.2 95.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 118.257 0.48 . . . . 0.0 110.552 174.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -60.27 -49.23 78.43 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.539 0.609 . . . . 0.0 112.619 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.83 -46.19 91.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.96 0.904 . . . . 0.0 110.676 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -59.57 -52.19 66.61 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.633 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.431 ' CH2' ' HE2' ' A' ' 91' ' ' LYS . 66.1 t90 -52.99 -43.42 66.42 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.814 1.188 . . . . 0.0 112.359 175.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -68.21 -43.32 78.28 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.226 0.921 . . . . 0.0 111.835 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -63.9 -46.62 84.03 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.337 -0.852 . . . . 0.0 112.079 174.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -56.72 -48.29 78.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.521 0.728 . . . . 0.0 110.306 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.431 ' HE2' ' CH2' ' A' ' 87' ' ' TRP . 1.2 tmmt? -56.08 -39.42 72.07 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.493 1.517 . . . . 0.0 112.501 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 mtpt -66.03 -37.6 86.3 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.888 1.222 . . . . 0.0 112.728 172.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.3 m -74.57 -39.29 62.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -153.59 104.97 2.53 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 128.387 2.675 . . . . 0.0 109.297 -170.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.53 -14.21 20.1 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.613 2.875 . . . . 0.0 116.506 -160.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.3 p-90 -66.76 -22.43 66.04 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -172.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -63.38 141.4 58.78 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.739 0.7 . . . . 0.0 112.428 -166.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -95.93 141.59 29.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.661 1.184 . . . . 0.0 111.536 174.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.405 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -91.44 117.48 29.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.752 1.221 . . . . 0.0 109.234 176.966 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -133.93 118.1 17.51 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.473 1.109 . . . . 0.0 111.559 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.405 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.58 57.13 0.81 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.61 1.195 . . . . 0.0 112.454 -177.577 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 98.7 p -63.11 159.15 17.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.318 162.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -52.86 -39.9 62.96 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.133 -0.98 . . . . 0.0 111.381 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.97 -40.78 96.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.329 1.052 . . . . 0.0 112.77 173.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -38.76 85.94 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.887 1.221 . . . . 0.0 111.935 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.04 -47.16 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 118.854 -0.594 . . . . 0.0 110.257 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -71.73 -27.06 62.74 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.102 0.864 . . . . 0.0 112.959 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -71.48 -40.0 70.54 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.396 1.078 . . . . 0.0 112.727 172.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -74.85 -38.44 61.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -132.86 80.8 59.96 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.959 1.704 . . . . 0.0 110.231 -168.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.37 -12.54 35.21 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.24 2.627 . . . . 0.0 114.746 -168.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -78.23 -8.65 58.6 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -78.02 -36.79 48.29 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.437 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 126.587 1.955 . . . . 0.0 115.084 170.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.8 153.55 25.2 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.413 1.485 . . . . 0.0 113.916 174.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.3 mt -121.33 149.92 42.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.36 1.464 . . . . 0.0 111.512 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -67.66 140.33 56.81 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.335 0.654 . . . . 0.0 110.123 162.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.16 -17.28 15.43 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.26 159.92 41.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.661 1.184 . . . . 0.0 112.835 -170.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.82 -164.26 53.36 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.354 0.978 . . . . 0.0 114.51 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.94 -24.15 75.28 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.555 2.837 . . . . 0.0 113.949 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.89 -6.78 59.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.723 1.609 . . . . 0.0 113.553 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.43 125.54 16.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.774 1.17 . . . . 0.0 112.104 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.88 -1.34 77.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 116.126 1.21 . . . . 0.0 116.126 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.3 mt -107.34 152.82 41.39 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 119.116 1.458 . . . . 0.0 112.289 -174.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -58.19 144.33 95.59 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 124.326 3.35 . . . . 0.0 112.874 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.0 t -79.48 -36.19 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 121.91 -0.493 . . . . 0.0 111.354 177.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -141.58 168.5 19.62 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.519 1.527 . . . . 0.0 112.874 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.9 -36.09 64.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.121 1.368 . . . . 0.0 111.99 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -60.31 -40.18 89.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.731 0.813 . . . . 0.0 112.262 174.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -68.17 -46.1 71.67 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.761 -0.587 . . . . 0.0 110.277 174.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.14 88.1 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.482 0.583 . . . . 0.0 112.106 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -62.69 -48.44 79.29 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.293 1.437 . . . . 0.0 111.466 177.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 57.2 t -70.28 -32.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.125 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.48 -46.03 88.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.434 1.47 . . . . 0.0 111.655 172.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -66.28 -38.11 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 118.822 0.737 . . . . 0.0 110.9 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -61.37 -50.57 72.35 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.535 -0.728 . . . . 0.0 111.977 174.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -62.9 -36.99 85.16 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.213 0.605 . . . . 0.0 111.957 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.18 -57.23 13.97 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.869 0.868 . . . . 0.0 111.152 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -54.11 -46.08 72.03 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.041 0.837 . . . . 0.0 111.942 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.21 -46.64 79.86 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.66 0.664 . . . . 0.0 111.793 -173.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.15 -46.19 85.16 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.514 0.726 . . . . 0.0 111.615 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -58.81 -50.78 72.68 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 122.01 -0.431 . . . . 0.0 110.944 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -54.79 -40.61 69.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.025 1.33 . . . . 0.0 112.236 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -69.63 -31.46 69.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.942 0.897 . . . . 0.0 113.02 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.4 m -82.67 -31.47 28.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -149.11 104.28 3.35 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 127.779 2.432 . . . . 0.0 109.43 -169.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.47 4.42 5.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.878 3.719 . . . . 0.0 116.717 -157.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 p-90 -89.63 -23.38 21.93 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.6 tp -65.89 140.01 58.32 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -158.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -92.18 138.64 31.36 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.201 1.0 . . . . 0.0 111.606 172.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.1 tt -84.37 117.13 23.41 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.66 1.184 . . . . 0.0 108.274 175.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -123.59 112.42 17.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.777 0.831 . . . . 0.0 110.94 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -152.28 141.95 21.85 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.298 1.047 . . . . 0.0 112.49 164.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.3 t -157.79 170.1 23.12 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 128.993 2.917 . . . . 0.0 107.217 173.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -49.7 -39.28 36.39 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.12 -0.988 . . . . 0.0 112.592 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -61.39 -44.06 97.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 112.1 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.51 -39.67 94.21 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.604 0.762 . . . . 0.0 112.028 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.29 -46.58 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 122.001 -0.437 . . . . 0.0 109.969 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -71.24 -21.36 62.12 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -79.81 -42.78 23.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.872 1.269 . . . . 0.0 112.76 172.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.61 -42.37 82.53 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.664 0.665 . . . . 0.0 112.248 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -127.84 84.69 62.61 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.36 1.464 . . . . 0.0 109.952 -166.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -69.25 -11.1 30.7 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.298 2.666 . . . . 0.0 114.485 -167.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.2 p-80 -82.67 -7.4 59.65 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 175.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.08 -35.21 28.88 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.349 0.977 . . . . 0.0 112.641 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.0 ptt180 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 117.792 -1.099 . . . . 0.0 113.086 168.722 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -116.81 150.73 37.86 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.5 mt -123.13 149.86 43.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.843 1.657 . . . . 0.0 112.176 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -70.34 141.56 52.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.109 0.964 . . . . 0.0 110.45 162.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.07 -17.1 15.07 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -172.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.99 159.98 40.85 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.58 1.152 . . . . 0.0 112.982 -170.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.46 -163.41 53.09 Favored Glycine 0 CA--C 1.542 1.755 0 C-N-CA 124.396 0.998 . . . . 0.0 114.397 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -59.73 -24.11 74.36 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.524 2.816 . . . . 0.0 113.86 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -5.98 59.34 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.659 1.583 . . . . 0.0 113.641 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.73 17.69 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.87 1.213 . . . . 0.0 112.148 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.75 -1.15 80.76 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 115.904 1.122 . . . . 0.0 115.904 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.4 mt -107.1 153.1 41.21 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.009 1.404 . . . . 0.0 112.221 -174.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -57.08 143.91 91.54 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.311 3.341 . . . . 0.0 113.123 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.4 t -78.13 -29.46 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.308 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -139.02 166.44 24.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.584 1.154 . . . . 0.0 112.86 -173.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.42 -34.69 72.8 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.612 -0.68 . . . . 0.0 111.989 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.7 t -70.76 -39.47 73.23 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.06 0.544 . . . . 0.0 111.728 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.17 -44.66 96.11 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.367 -0.833 . . . . 0.0 110.722 171.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.26 -47.18 87.09 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.546 -0.721 . . . . 0.0 112.641 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -56.55 -47.12 80.14 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.643 . . . . 0.0 111.891 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 43.3 t -77.45 -30.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 118.342 -0.837 . . . . 0.0 112.613 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.04 -44.64 97.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.721 1.601 . . . . 0.0 111.22 169.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.53 -41.41 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.367 0.53 . . . . 0.0 110.952 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -60.29 -48.76 80.38 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.945 0.793 . . . . 0.0 112.288 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -64.71 -39.81 94.29 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 118.949 0.795 . . . . 0.0 111.989 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -58.68 -53.16 61.52 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.944 0.897 . . . . 0.0 111.146 171.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -55.56 -45.54 77.28 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.74 174.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -48.72 79.88 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.514 1.052 . . . . 0.0 111.733 -175.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.29 -49.33 77.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.027 0.531 . . . . 0.0 111.654 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -59.21 -52.49 65.47 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 119.093 -0.479 . . . . 0.0 111.144 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -51.87 -44.1 63.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.163 1.785 . . . . 0.0 112.282 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -73.3 -26.06 60.91 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -85.95 -29.49 23.54 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 169.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -151.37 105.1 2.93 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 128.387 2.675 . . . . 0.0 109.433 -168.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.2 -11.6 23.1 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 124.169 3.246 . . . . 0.0 116.583 -160.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -68.2 -25.78 65.4 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -172.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.8 tp -70.82 144.82 50.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -158.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -105.6 143.56 33.59 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.928 1.691 . . . . 0.0 111.594 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -93.31 119.31 32.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.202 1.401 . . . . 0.0 109.73 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -135.15 120.01 18.49 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.535 1.134 . . . . 0.0 111.672 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.421 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.67 50.13 0.75 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.786 1.234 . . . . 0.0 112.962 -176.649 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.0 m -66.96 161.5 24.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.683 0.793 . . . . 0.0 111.354 164.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -51.66 -39.57 58.42 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.179 -0.951 . . . . 0.0 112.99 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.7 -41.19 94.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 112.729 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.07 -38.73 91.73 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.218 0.917 . . . . 0.0 111.715 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.81 -46.95 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.289 177.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -69.98 -29.45 66.56 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -72.14 -40.23 68.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.162 0.985 . . . . 0.0 112.827 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -74.15 -41.56 61.33 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.805 0.729 . . . . 0.0 112.138 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -128.17 91.63 43.9 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.32 1.848 . . . . 0.0 110.282 -172.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.26 -14.98 35.1 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.182 2.588 . . . . 0.0 114.669 -167.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -81.23 -5.54 57.87 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.27 -29.04 21.95 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 . . . . . 0 C--O 1.256 1.403 0 CA-C-N 119.62 1.1 . . . . 0.0 112.881 178.327 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.56 152.11 22.8 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.34 150.66 46.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.737 1.615 . . . . 0.0 112.128 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -69.72 132.16 45.7 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.745 0.818 . . . . 0.0 109.981 162.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -25.57 17.37 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.27 164.36 30.46 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.195 1.398 . . . . 0.0 112.392 -171.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.46 -166.16 54.62 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.292 0.948 . . . . 0.0 114.48 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.26 -28.64 72.53 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.033 3.156 . . . . 0.0 114.646 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.12 2.95 55.22 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.046 1.338 . . . . 0.0 113.511 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.69 127.1 15.15 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 119.133 0.879 . . . . 0.0 112.323 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.45 -3.64 79.27 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 115.953 1.141 . . . . 0.0 115.953 -177.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 mt -107.37 155.04 40.22 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 118.966 1.383 . . . . 0.0 112.56 -172.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -57.19 144.41 90.63 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.278 3.319 . . . . 0.0 113.015 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 38.2 t -80.11 -28.81 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 122.376 0.27 . . . . 0.0 111.327 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.4 p -139.15 166.08 25.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.574 1.15 . . . . 0.0 112.88 -173.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -60.79 -36.41 78.93 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 173.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.9 t -65.21 -44.87 86.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.849 0.86 . . . . 0.0 111.36 174.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -60.89 -43.55 98.31 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.469 -0.769 . . . . 0.0 111.078 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.34 81.21 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.47 -0.769 . . . . 0.0 112.634 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.5 ttt85 -61.16 -41.5 96.88 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.937 1.295 . . . . 0.0 111.893 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.31 -34.26 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.182 -0.914 . . . . 0.0 112.211 177.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 47.0 mt -61.31 -45.64 93.6 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.878 1.672 . . . . 0.0 111.355 171.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.17 -43.87 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 117.974 0.352 . . . . 0.0 110.47 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -58.62 -49.79 76.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.256 0.48 . . . . 0.0 112.12 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.31 -36.47 71.63 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.521 -0.737 . . . . 0.0 112.271 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -60.84 -50.78 72.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 118.463 -0.78 . . . . 0.0 110.728 169.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -53.18 -43.7 67.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.419 1.009 . . . . 0.0 111.665 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -63.67 -45.04 91.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 120.076 1.307 . . . . 0.0 112.237 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.1 -46.27 81.76 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.545 -0.722 . . . . 0.0 112.615 173.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -59.87 -48.09 83.09 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.592 -0.693 . . . . 0.0 110.493 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -57.34 -42.15 81.39 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.255 1.822 . . . . 0.0 111.986 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -59.55 -44.93 93.11 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.311 0.645 . . . . 0.0 112.451 170.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.7 m -77.09 -29.16 54.83 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -151.43 107.35 2.94 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 127.806 2.443 . . . . 0.0 109.312 -168.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.23 -14.48 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.826 3.017 . . . . 0.0 116.113 -160.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -70.96 -25.37 62.69 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -171.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -67.66 145.97 54.28 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -157.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -109.51 144.92 37.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.261 1.824 . . . . 0.0 111.5 173.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.46 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -98.18 122.2 41.04 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.85 1.66 . . . . 0.0 109.995 -177.199 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -137.59 120.35 16.31 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.658 1.183 . . . . 0.0 111.882 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.46 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.11 55.24 0.65 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.512 1.125 . . . . 0.0 113.385 -176.091 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.3 t -66.14 157.01 32.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.611 0.764 . . . . 0.0 110.913 161.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -54.26 -32.43 56.1 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.905 -1.122 . . . . 0.0 112.719 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.23 -41.32 96.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.062 0.945 . . . . 0.0 112.579 171.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.01 -38.22 87.92 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.601 0.76 . . . . 0.0 111.73 174.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.71 -47.14 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.302 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.76 -32.37 72.92 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.777 0.717 . . . . 0.0 112.385 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -69.02 -40.82 78.44 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.586 0.754 . . . . 0.0 112.625 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 78.6 mtt-85 -72.72 -39.32 67.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.965 0.906 . . . . 0.0 112.736 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -133.67 85.06 43.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.155 1.782 . . . . 0.0 109.979 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.97 -13.74 37.2 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.25 2.633 . . . . 0.0 114.611 -167.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -77.29 -8.86 58.32 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.78 -29.59 23.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 . . . . . 0 C--O 1.254 1.316 0 CA-C-N 119.42 1.009 . . . . 0.0 112.94 179.002 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -103.95 150.54 24.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.98 148.83 45.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.488 1.515 . . . . 0.0 112.02 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.62 142.05 53.56 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.057 0.943 . . . . 0.0 110.462 162.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.0 -15.57 15.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -137.95 158.64 43.92 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.462 1.105 . . . . 0.0 113.388 -169.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.79 -161.93 51.19 Favored Glycine 0 CA--C 1.542 1.724 0 C-N-CA 124.494 1.045 . . . . 0.0 114.411 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.16 -24.33 73.36 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.441 2.761 . . . . 0.0 113.91 179.221 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.78 -6.85 59.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.541 1.537 . . . . 0.0 113.523 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 125.09 16.05 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.007 1.276 . . . . 0.0 112.056 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.89 -0.5 79.47 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 116.121 1.208 . . . . 0.0 116.121 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 27.7 mt -106.56 152.96 40.86 Favored Pre-proline 0 CA--C 1.55 0.963 0 CA-C-N 118.924 1.362 . . . . 0.0 112.284 -174.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -56.97 143.42 92.44 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.505 3.47 . . . . 0.0 112.952 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.1 t -77.96 -39.33 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.899 -0.5 . . . . 0.0 111.452 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.1 t -134.67 164.15 28.17 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.254 1.422 . . . . 0.0 112.678 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -59.97 -27.23 66.66 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.003 -1.061 . . . . 0.0 112.833 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.5 m -68.86 -35.34 76.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 171.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -65.17 -44.56 88.08 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.257 0.935 . . . . 0.0 109.736 169.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.99 93.37 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 -56.32 -48.54 76.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.822 1.649 . . . . 0.0 111.502 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.5 t -73.89 -33.45 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 118.546 -0.74 . . . . 0.0 112.186 -178.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.13 -47.97 82.2 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 120.262 1.392 . . . . 0.0 111.1 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.77 -43.37 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 122.885 0.474 . . . . 0.0 110.789 175.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -59.5 -52.47 65.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.747 0.819 . . . . 0.0 112.41 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -68.56 -34.65 76.2 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.678 -0.639 . . . . 0.0 112.337 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -61.47 -53.21 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.14 170.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -52.17 -45.74 65.23 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.359 172.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -64.87 -42.1 95.13 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.646 1.112 . . . . 0.0 112.679 -175.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -62.97 -47.98 80.84 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.896 0.771 . . . . 0.0 111.506 173.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.0 mmp_? -59.66 -50.84 72.3 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.715 -0.616 . . . . 0.0 110.918 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -52.46 -41.34 63.23 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.596 1.959 . . . . 0.0 112.6 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -67.59 -36.73 81.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.116 . . . . 0.0 111.874 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 t -79.49 -33.23 42.36 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 176.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -152.98 112.14 2.69 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 128.427 2.691 . . . . 0.0 109.669 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.94 -11.64 18.0 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 124.34 3.36 . . . . 0.0 116.401 -161.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -66.74 -24.84 66.28 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -172.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.91 144.16 49.07 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -159.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -103.04 147.94 26.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.048 1.739 . . . . 0.0 112.174 171.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.417 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -98.97 118.24 35.29 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.543 1.537 . . . . 0.0 109.26 -179.709 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -134.34 115.35 13.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.38 1.072 . . . . 0.0 111.922 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.417 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.13 49.43 0.78 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.84 1.256 . . . . 0.0 112.997 -175.369 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.1 t -64.21 156.31 29.11 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.809 162.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -50.28 -36.89 33.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.447 1.099 . . . . 0.0 112.029 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -61.74 -42.45 98.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.137 0.975 . . . . 0.0 112.251 174.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.04 89.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.695 0.679 . . . . 0.0 111.49 174.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.4 -45.74 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.996 -0.44 . . . . 0.0 110.342 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -68.01 -31.49 71.21 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -72.1 -40.26 68.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.281 1.032 . . . . 0.0 112.835 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -74.31 -37.28 63.67 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.754 0.822 . . . . 0.0 112.802 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -132.95 88.59 36.71 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.857 1.663 . . . . 0.0 110.205 -170.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -70.21 -10.56 28.48 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.329 2.686 . . . . 0.0 114.819 -166.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -82.81 -6.61 59.51 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.64 -32.45 23.66 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.365 0.984 . . . . 0.0 113.217 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 . . . . . 0 C--O 1.256 1.395 0 C-N-CA 123.839 0.856 . . . . 0.0 113.127 169.54 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.482 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.49 152.63 23.41 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -124.14 150.43 45.12 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.582 1.553 . . . . 0.0 111.83 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -68.34 131.66 45.71 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.543 0.737 . . . . 0.0 110.182 164.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.3 -18.4 22.49 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.49 167.49 27.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 112.904 -173.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.62 -168.86 54.81 Favored Glycine 0 CA--C 1.542 1.73 0 C-N-CA 124.105 0.86 . . . . 0.0 114.571 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.6 -28.51 75.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.166 3.244 . . . . 0.0 114.542 -174.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.3 mt -95.47 3.76 53.93 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.996 1.318 . . . . 0.0 113.507 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.29 128.94 17.79 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.941 0.791 . . . . 0.0 112.489 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.59 -5.25 82.46 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 -176.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.5 mt -106.82 155.97 38.11 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 118.919 1.359 . . . . 0.0 112.166 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -56.89 142.31 93.04 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.099 3.199 . . . . 0.0 112.88 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -78.35 -32.05 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.91 174.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -134.23 166.52 22.59 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.468 1.107 . . . . 0.0 113.304 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -62.74 -36.24 82.39 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.436 -0.79 . . . . 0.0 111.269 173.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -65.23 -41.34 94.47 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.064 0.946 . . . . 0.0 111.823 173.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -60.54 -46.0 91.79 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.878 0.763 . . . . 0.0 110.452 172.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.1 91.5 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -57.35 -46.55 83.19 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.711 1.204 . . . . 0.0 111.218 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.5 t -73.15 -32.45 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.717 0.807 . . . . 0.0 112.428 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.4 mt -62.15 -47.19 85.64 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 120.27 1.395 . . . . 0.0 110.955 170.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.05 -41.24 92.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 118.833 0.742 . . . . 0.0 110.675 176.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -59.85 -51.22 70.66 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -66.85 -39.76 87.69 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.698 -0.626 . . . . 0.0 111.521 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -56.99 -52.74 64.04 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.821 0.848 . . . . 0.0 111.201 172.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -52.52 -45.24 66.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.298 -0.858 . . . . 0.0 112.12 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -68.88 -40.67 79.09 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.717 1.144 . . . . 0.0 112.8 -174.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.72 -45.47 89.8 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.212 -0.93 . . . . 0.0 112.004 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -58.37 -52.1 67.03 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.763 -0.586 . . . . 0.0 110.653 174.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.46 -40.61 51.26 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 126.432 1.893 . . . . 0.0 112.509 173.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -69.63 -34.23 73.75 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.076 0.95 . . . . 0.0 111.771 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.0 t -78.44 -37.89 42.58 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 173.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -153.47 108.73 2.58 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.797 2.839 . . . . 0.0 109.584 -171.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 -13.87 18.35 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.007 3.138 . . . . 0.0 116.656 -160.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -65.09 -25.33 67.75 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.294 1.591 . . . . 0.0 115.294 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 34.0 tp -65.61 142.89 57.91 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -162.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 68.7 mtp85 -87.04 148.06 25.44 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.505 1.122 . . . . 0.0 113.163 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.31 108.25 19.83 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.852 1.261 . . . . 0.0 108.754 167.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -132.31 122.92 25.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.819 1.248 . . . . 0.0 110.005 173.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.83 64.21 0.79 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -175.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -65.63 162.87 17.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.076 0.95 . . . . 0.0 112.155 166.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -53.96 -36.5 62.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.849 -1.157 . . . . 0.0 111.784 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -62.77 -40.97 98.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.974 0.91 . . . . 0.0 112.402 172.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.27 91.27 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.639 1.109 . . . . 0.0 112.059 172.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -47.3 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.143 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -69.15 -30.93 69.27 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.018 0.826 . . . . 0.0 112.491 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -70.33 -37.77 74.76 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.296 1.038 . . . . 0.0 112.943 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.9 -42.73 63.27 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 119.042 0.837 . . . . 0.0 112.816 169.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -132.33 84.16 52.82 Favored Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 125.814 1.646 . . . . 0.0 110.131 -163.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.6 -14.95 40.68 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.245 2.63 . . . . 0.0 114.506 -166.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -77.17 -8.28 57.27 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.84 -21.43 23.71 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 . . . . . 0 C--O 1.253 1.282 0 CA-C-N 119.871 1.214 . . . . 0.0 112.451 175.692 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.48 154.47 32.46 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 114.538 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -126.05 149.13 49.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 112.085 -177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -70.64 142.38 51.63 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.025 0.93 . . . . 0.0 110.485 162.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.67 -14.14 14.88 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.55 158.23 44.64 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.596 1.159 . . . . 0.0 113.034 -171.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.38 -162.86 51.72 Favored Glycine 0 CA--C 1.54 1.638 0 C-N-CA 124.373 0.987 . . . . 0.0 114.442 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.3 -24.42 74.21 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.627 2.885 . . . . 0.0 113.871 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.25 -7.38 59.61 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.638 1.575 . . . . 0.0 113.68 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.41 16.88 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.796 1.18 . . . . 0.0 112.061 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.14 -0.76 79.1 Favored Glycine 0 CA--C 1.53 1.01 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.11 153.55 40.95 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 119.002 1.401 . . . . 0.0 112.144 -174.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -56.16 142.84 86.28 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 124.327 3.351 . . . . 0.0 113.071 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.2 t -77.32 -33.76 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.746 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.9 p -133.84 164.45 27.22 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.614 1.166 . . . . 0.0 113.274 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -60.57 -31.28 70.41 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.332 -0.855 . . . . 0.0 112.685 172.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.6 m -69.42 -41.42 76.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.66 173.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.25 -45.05 96.14 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.708 0.685 . . . . 0.0 110.463 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.62 85.34 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.507 0.723 . . . . 0.0 112.251 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -56.64 -45.62 81.49 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.885 1.274 . . . . 0.0 111.797 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.33 -33.87 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.532 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.85 -44.08 97.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.409 1.458 . . . . 0.0 111.193 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.43 -42.49 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.528 0.603 . . . . 0.0 110.8 174.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -60.57 -50.15 74.67 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.79 -0.569 . . . . 0.0 112.286 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -69.09 -35.1 76.1 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.571 -0.706 . . . . 0.0 112.234 -177.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.55 -56.24 23.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.262 1.025 . . . . 0.0 110.541 169.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -52.87 -45.61 67.51 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.911 173.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -67.42 -41.75 84.31 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.344 0.975 . . . . 0.0 112.238 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.49 -43.98 79.64 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.214 -0.929 . . . . 0.0 111.611 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.6 -49.56 76.01 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.654 -0.654 . . . . 0.0 110.759 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -54.96 -43.05 73.11 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.396 1.878 . . . . 0.0 112.453 175.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -63.33 -36.99 85.53 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.675 0.79 . . . . 0.0 112.146 175.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.6 m -77.64 -36.71 51.22 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -152.93 103.99 2.65 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 128.094 2.558 . . . . 0.0 109.788 -168.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.67 -13.32 22.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.095 3.197 . . . . 0.0 116.679 -160.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -65.5 -24.2 67.08 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -172.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.64 146.61 54.6 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -163.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -100.42 150.95 22.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.252 1.421 . . . . 0.0 113.232 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.409 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -109.37 117.87 35.17 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.791 1.636 . . . . 0.0 109.535 -177.451 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.29 120.48 18.9 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.555 1.142 . . . . 0.0 111.613 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.409 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -151.51 53.08 0.83 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.589 1.156 . . . . 0.0 113.043 -176.128 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.8 t -67.8 157.09 35.57 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.785 160.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -54.3 -31.6 54.44 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.853 -1.154 . . . . 0.0 112.781 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -61.52 -41.54 97.48 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 112.036 172.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.95 -38.73 89.36 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.798 0.839 . . . . 0.0 111.849 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.61 -47.44 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.318 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -67.92 -32.59 73.15 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.624 0.647 . . . . 0.0 112.264 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -69.8 -39.24 76.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.626 -0.672 . . . . 0.0 112.601 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 -71.82 -41.95 67.61 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.694 0.679 . . . . 0.0 112.649 172.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.77 83.31 61.95 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.701 1.601 . . . . 0.0 110.133 -165.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.35 -14.66 40.73 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 -166.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.7 p-80 -77.49 -8.32 57.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.52 -29.56 25.85 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.489 1.04 . . . . 0.0 113.593 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.066 0.947 . . . . 0.0 112.741 177.509 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -100.4 140.84 34.08 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 174.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.48 152.06 50.14 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.614 1.566 . . . . 0.0 112.219 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -68.11 145.39 54.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.455 1.502 . . . . 0.0 111.343 175.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.2 -13.79 14.84 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -138.76 158.96 43.26 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.568 1.147 . . . . 0.0 112.93 -171.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.19 -164.09 52.3 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 124.396 0.998 . . . . 0.0 114.436 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.98 -23.79 74.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.404 2.736 . . . . 0.0 113.844 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mp -84.27 -5.66 59.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.532 1.533 . . . . 0.0 113.76 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.91 127.28 23.13 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.992 1.269 . . . . 0.0 112.147 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.28 -7.67 80.2 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.724 1.154 . . . . 0.0 115.698 -176.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.7 mt -104.43 149.65 37.61 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 118.893 1.347 . . . . 0.0 112.058 -170.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -58.76 146.43 92.59 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 124.371 3.381 . . . . 0.0 113.019 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.85 -28.63 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.397 175.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 p -140.3 167.2 22.69 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.468 1.107 . . . . 0.0 112.823 -172.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -65.61 -33.94 77.07 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.854 0.862 . . . . 0.0 111.772 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.8 t -69.05 -42.03 76.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.561 0.744 . . . . 0.0 111.83 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -64.6 -38.46 91.07 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.502 -0.749 . . . . 0.0 111.466 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.65 -46.37 90.05 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.45 -0.781 . . . . 0.0 112.419 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -56.1 -44.49 79.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.232 1.413 . . . . 0.0 112.016 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.03 -35.44 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-O 118.4 -0.809 . . . . 0.0 112.149 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.33 -44.18 97.08 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.616 1.553 . . . . 0.0 111.361 172.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.76 -40.94 90.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 118.286 0.494 . . . . 0.0 110.863 174.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.94 -46.69 88.22 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.563 -0.711 . . . . 0.0 112.578 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.17 -38.37 90.34 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.496 0.719 . . . . 0.0 111.632 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -59.65 -55.85 29.3 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.005 169.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -54.14 -42.11 69.18 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.605 1.093 . . . . 0.0 112.692 177.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.96 -49.44 77.69 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.767 1.167 . . . . 0.0 112.649 175.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.92 -49.61 77.03 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.276 -0.89 . . . . 0.0 111.489 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmt-85 -61.22 -49.37 77.4 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.984 0.913 . . . . 0.0 110.372 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.36 -38.12 79.62 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.188 1.395 . . . . 0.0 112.565 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -66.12 -37.49 85.85 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.088 0.858 . . . . 0.0 112.311 173.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.1 m -76.81 -36.78 56.69 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -153.49 104.38 2.55 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 128.174 2.59 . . . . 0.0 109.617 -168.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.88 -13.01 24.16 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.041 3.16 . . . . 0.0 116.65 -160.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -67.94 -24.12 65.14 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -171.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -65.25 143.1 58.03 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -161.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -93.37 147.37 22.99 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.901 1.28 . . . . 0.0 111.862 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.82 118.03 36.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.497 1.519 . . . . 0.0 109.276 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.6 115.53 14.79 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.404 1.082 . . . . 0.0 111.721 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.68 49.43 0.87 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.809 1.244 . . . . 0.0 112.973 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.3 t -64.6 157.08 27.98 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.72 160.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -51.7 -38.97 57.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.212 1.005 . . . . 0.0 112.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -62.65 -37.04 84.8 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.854 0.862 . . . . 0.0 113.091 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.28 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 118.933 0.788 . . . . 0.0 111.417 173.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.53 -47.61 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.151 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -69.31 -29.56 67.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.846 0.748 . . . . 0.0 112.269 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -74.4 -36.14 63.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 175.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -78.25 -39.7 39.44 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.266 0.939 . . . . 0.0 111.967 174.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -127.36 90.29 49.18 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.313 1.845 . . . . 0.0 110.329 -172.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -71.28 -12.68 30.21 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.204 2.603 . . . . 0.0 115.086 -165.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -82.68 -5.07 58.66 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.77 -19.68 28.72 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-N 119.904 1.229 . . . . 0.0 111.167 165.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.82 153.98 33.62 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.284 1.434 . . . . 0.0 114.423 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.6 mt -124.41 149.2 46.99 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.411 1.484 . . . . 0.0 111.884 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.31 140.35 54.35 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.806 0.842 . . . . 0.0 110.182 162.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.9 -16.96 15.21 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.08 159.87 41.14 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.749 1.22 . . . . 0.0 112.959 -170.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.92 -164.1 53.59 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 124.335 0.969 . . . . 0.0 114.37 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.89 -24.15 75.14 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.611 2.874 . . . . 0.0 113.829 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -84.38 -6.19 59.36 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.826 1.65 . . . . 0.0 113.528 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.61 125.82 17.74 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 119.841 1.201 . . . . 0.0 112.13 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.35 -1.23 79.21 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 116.003 1.161 . . . . 0.0 116.003 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.5 mt -106.82 153.14 40.97 Favored Pre-proline 0 CA--C 1.55 0.957 0 CA-C-N 119.08 1.44 . . . . 0.0 112.382 -174.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -55.37 141.54 81.52 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 124.364 3.376 . . . . 0.0 112.901 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 t -76.44 -33.76 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.285 -0.259 . . . . 0.0 110.886 172.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.65 166.47 22.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.823 1.249 . . . . 0.0 113.015 -174.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -33.43 74.27 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.295 -0.878 . . . . 0.0 111.62 172.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.2 m -66.11 -40.11 90.48 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.48 0.712 . . . . 0.0 111.534 174.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -63.0 -45.63 91.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.771 0.714 . . . . 0.0 110.621 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.58 89.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.723 0.692 . . . . 0.0 112.386 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -54.18 -49.74 68.64 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.026 1.73 . . . . 0.0 111.254 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.25 -31.33 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.426 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.5 -47.44 83.96 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.431 1.469 . . . . 0.0 111.258 170.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.3 mt -62.14 -43.32 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.532 0.605 . . . . 0.0 110.69 175.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.37 -50.95 71.57 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.538 0.735 . . . . 0.0 112.325 177.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -69.04 -33.76 74.1 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.537 -0.727 . . . . 0.0 112.071 -177.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -60.43 -54.71 42.35 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.663 0.785 . . . . 0.0 110.86 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 64.0 t90 -49.83 -47.01 51.8 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.306 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -64.02 -46.46 84.38 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 120.113 1.324 . . . . 0.0 112.131 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.6 -45.59 89.63 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.555 -0.716 . . . . 0.0 111.894 175.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -57.33 -49.45 76.08 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.875 -0.516 . . . . 0.0 110.633 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt -55.62 -41.0 72.89 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.617 1.567 . . . . 0.0 112.183 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -65.76 -39.31 90.91 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -77.87 -32.75 52.15 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -155.44 111.32 2.23 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 128.288 2.635 . . . . 0.0 109.393 -166.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -75.59 -11.95 20.4 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 124.016 3.144 . . . . 0.0 116.359 -160.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.4 p-90 -67.82 -30.73 70.21 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -171.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.1 tt -72.36 141.57 48.77 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.487 0.715 . . . . 0.0 111.768 -156.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -114.55 142.23 46.7 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.357 1.463 . . . . 0.0 111.887 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.408 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -90.15 119.86 30.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.036 1.334 . . . . 0.0 110.304 -172.325 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.85 120.32 18.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.636 1.174 . . . . 0.0 111.741 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.408 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -150.19 54.76 0.92 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.962 1.305 . . . . 0.0 112.441 -177.478 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -63.79 163.41 11.76 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.346 1.058 . . . . 0.0 112.185 165.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -50.23 -44.0 53.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.996 0.919 . . . . 0.0 111.041 173.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -61.01 -44.36 97.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.466 1.106 . . . . 0.0 112.292 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -39.53 87.68 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.381 0.991 . . . . 0.0 112.464 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.69 -48.16 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.072 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -69.34 -27.17 65.12 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.815 0.734 . . . . 0.0 112.764 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -72.96 -42.02 63.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.661 1.184 . . . . 0.0 112.691 172.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.1 mtt85 -73.14 -37.42 66.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -134.84 82.63 43.26 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 126.067 1.747 . . . . 0.0 110.168 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.63 -12.13 33.81 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.32 2.68 . . . . 0.0 114.679 -168.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -79.05 -7.87 58.48 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.65 -31.14 26.34 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.611 1.096 . . . . 0.0 113.304 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 . . . . . 0 C--O 1.256 1.407 0 CA-C-N 119.386 0.994 . . . . 0.0 111.887 168.776 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.34 156.39 18.56 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -128.09 148.58 50.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -71.29 141.77 50.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.127 0.971 . . . . 0.0 110.412 163.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.59 -15.15 14.85 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.69 158.95 43.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.625 1.17 . . . . 0.0 113.087 -170.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.63 -162.84 52.08 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.444 1.021 . . . . 0.0 114.396 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.44 -24.04 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.469 2.779 . . . . 0.0 113.839 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.08 -6.61 59.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.723 1.609 . . . . 0.0 113.64 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.2 16.19 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.934 1.243 . . . . 0.0 112.029 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.26 -0.44 78.27 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 115.971 1.148 . . . . 0.0 115.971 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.7 mt -106.51 153.05 40.8 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 119.07 1.435 . . . . 0.0 112.537 -174.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -54.7 144.04 66.88 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.575 3.516 . . . . 0.0 113.213 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.7 t -80.91 -33.9 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 122.651 0.38 . . . . 0.0 110.896 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -130.97 165.77 22.43 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.763 1.225 . . . . 0.0 113.309 -175.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -62.82 -35.33 79.57 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.375 -0.828 . . . . 0.0 111.05 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.3 m -65.12 -41.46 94.86 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.157 0.983 . . . . 0.0 111.893 173.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -61.17 -46.39 90.68 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.957 0.799 . . . . 0.0 110.486 173.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.73 88.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.348 0.659 . . . . 0.0 112.51 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -61.57 -42.56 99.03 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.295 1.438 . . . . 0.0 112.099 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 67.6 t -73.83 -34.51 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.466 176.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.89 -44.21 96.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 120.492 1.496 . . . . 0.0 111.287 172.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.26 -42.99 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.214 0.461 . . . . 0.0 110.815 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -57.89 -52.81 63.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.744 0.702 . . . . 0.0 112.179 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -63.14 -41.17 99.24 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.719 0.69 . . . . 0.0 112.093 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.09 -51.21 71.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.989 0.516 . . . . 0.0 111.062 175.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.23 -45.36 72.28 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.915 171.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.12 -46.64 83.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.034 1.288 . . . . 0.0 112.204 -173.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -65.73 -42.84 90.57 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.443 -0.785 . . . . 0.0 111.882 176.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -60.4 -50.02 75.27 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.673 -0.642 . . . . 0.0 111.193 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -55.22 -40.85 71.31 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.972 1.709 . . . . 0.0 112.03 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -64.98 -40.17 94.58 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.59 0.756 . . . . 0.0 112.697 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.5 m -80.62 -29.31 36.81 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -150.98 110.15 3.07 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 128.225 2.61 . . . . 0.0 109.254 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.1 -11.52 21.3 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.765 2.977 . . . . 0.0 116.115 -161.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.7 p-90 -76.73 -19.94 57.1 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -170.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.33 147.85 45.91 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.455 1.025 . . . . 0.0 113.452 -164.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -114.02 149.66 35.07 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 125.124 1.37 . . . . 0.0 112.189 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.451 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -94.22 121.08 35.36 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.61 1.564 . . . . 0.0 109.681 -175.209 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -137.55 112.4 8.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.196 0.999 . . . . 0.0 111.945 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.451 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -149.47 51.69 0.94 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.833 1.253 . . . . 0.0 113.099 -177.025 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 t -66.2 157.34 31.65 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.74 160.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -52.71 -36.9 58.23 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.145 0.978 . . . . 0.0 112.338 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -63.58 -37.44 87.32 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.81 0.844 . . . . 0.0 112.491 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.39 91.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.962 0.801 . . . . 0.0 111.249 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.83 -46.5 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 119.018 -0.515 . . . . 0.0 110.228 177.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -71.15 -27.17 63.35 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.994 0.815 . . . . 0.0 112.719 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.67 -46.17 73.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 112.152 171.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -79.49 -30.8 42.15 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -134.4 77.79 58.91 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 126.173 1.789 . . . . 0.0 110.377 -172.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.42 -8.78 24.52 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.643 2.895 . . . . 0.0 114.997 -168.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -81.58 -9.5 59.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.54 -45.68 24.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.177 0.899 . . . . 0.0 111.848 177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 117.216 2.302 . . . . 0.0 117.216 177.558 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.7 159.12 16.46 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.611 1.565 . . . . 0.0 114.068 172.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.02 149.83 50.68 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.411 1.485 . . . . 0.0 111.538 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -68.85 130.3 42.39 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.311 0.644 . . . . 0.0 109.828 162.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.05 -24.07 17.75 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.26 164.11 31.14 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.363 1.465 . . . . 0.0 112.275 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.98 -167.41 54.67 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 124.179 0.895 . . . . 0.0 114.637 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.44 -28.32 72.59 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 124.114 3.209 . . . . 0.0 114.685 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.0 mt -95.63 2.96 54.39 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.081 1.353 . . . . 0.0 113.536 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.61 127.28 15.34 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.946 0.793 . . . . 0.0 112.396 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.81 -4.65 75.75 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -176.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.5 mt -107.11 155.4 39.35 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 118.932 1.366 . . . . 0.0 112.487 -173.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -55.04 145.5 63.42 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.337 3.358 . . . . 0.0 112.814 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.9 t -81.62 -32.05 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.062 -0.399 . . . . 0.0 110.778 171.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -134.45 167.26 21.08 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.783 1.233 . . . . 0.0 113.487 -175.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.2 mtm180 -62.57 -34.8 77.7 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 121.639 -0.663 . . . . 0.0 111.942 173.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 t -66.16 -42.73 88.6 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.607 0.763 . . . . 0.0 111.243 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -60.2 -46.71 88.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.676 -0.64 . . . . 0.0 110.672 173.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.91 88.63 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.706 0.802 . . . . 0.0 112.394 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -61.95 -42.05 98.67 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.56 1.144 . . . . 0.0 112.041 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 62.0 t -72.81 -35.08 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.336 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.06 -43.99 97.07 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.542 1.519 . . . . 0.0 111.294 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.76 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.529 0.604 . . . . 0.0 110.741 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.22 -50.26 74.35 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.841 0.746 . . . . 0.0 112.195 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -64.0 -38.52 91.38 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.438 0.695 . . . . 0.0 112.265 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.22 -53.79 53.49 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.992 0.917 . . . . 0.0 110.951 173.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 67.9 t90 -54.08 -46.27 72.0 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.264 173.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.76 -45.62 88.99 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.293 0.951 . . . . 0.0 112.39 -173.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -64.09 -49.42 72.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.758 0.823 . . . . 0.0 111.763 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -61.09 -49.15 78.49 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.817 -0.552 . . . . 0.0 111.252 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -56.93 -41.29 77.95 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.111 1.364 . . . . 0.0 112.817 175.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -64.01 -33.67 76.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.605 1.093 . . . . 0.0 112.777 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -77.6 -37.41 50.41 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 172.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -150.11 107.42 3.2 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 128.003 2.521 . . . . 0.0 109.952 -172.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.04 -12.33 23.62 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.338 3.359 . . . . 0.0 117.13 -157.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 21.7 p-90 -69.75 -19.79 63.52 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -172.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 36.1 tp -67.27 138.79 57.13 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -159.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -83.83 148.78 26.8 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.54 1.536 . . . . 0.0 111.72 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 tt -114.91 119.56 36.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.767 1.627 . . . . 0.0 109.15 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -139.12 114.5 9.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.468 1.107 . . . . 0.0 111.487 174.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.66 49.58 1.14 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.0 m -73.62 161.01 30.78 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.736 0.814 . . . . 0.0 110.993 160.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -51.84 -38.25 55.13 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.953 0.901 . . . . 0.0 113.175 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -60.0 -40.85 90.62 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.24 -38.17 89.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.74 -47.02 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.403 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -69.46 -31.79 70.31 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.947 0.794 . . . . 0.0 112.562 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -70.39 -37.2 74.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.841 0.857 . . . . 0.0 113.257 174.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -73.14 -41.22 64.2 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.03 0.832 . . . . 0.0 112.85 171.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.9 82.42 64.23 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.728 1.611 . . . . 0.0 110.156 -165.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -70.07 -10.11 27.56 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.484 2.789 . . . . 0.0 114.589 -167.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -78.52 -10.31 59.67 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.5 -31.64 32.77 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.508 1.049 . . . . 0.0 113.316 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 119.577 1.081 . . . . 0.0 112.728 171.975 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.16 151.07 26.95 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.94 149.16 44.62 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.622 1.569 . . . . 0.0 111.964 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -69.08 141.5 54.73 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.85 0.86 . . . . 0.0 110.438 162.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.51 -15.96 14.85 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -172.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.87 159.1 42.94 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.726 1.211 . . . . 0.0 113.158 -170.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.09 -163.57 52.4 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 124.364 0.983 . . . . 0.0 114.44 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.06 -24.35 73.15 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.545 2.83 . . . . 0.0 113.99 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.1 -6.82 59.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.706 1.603 . . . . 0.0 113.625 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.44 16.76 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.68 1.127 . . . . 0.0 111.967 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.36 -0.93 78.75 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 116.102 1.201 . . . . 0.0 116.102 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.59 153.21 41.52 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 119.127 1.464 . . . . 0.0 112.082 -174.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -55.09 143.49 73.74 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.435 3.423 . . . . 0.0 113.492 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.5 t -78.01 -37.8 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.983 -0.448 . . . . 0.0 111.358 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.9 t -139.06 166.1 25.39 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.367 1.467 . . . . 0.0 112.671 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -57.68 -29.44 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.094 -1.004 . . . . 0.0 112.896 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -62.38 -43.07 99.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.572 0.749 . . . . 0.0 111.941 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -64.68 -43.15 94.45 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.565 -0.71 . . . . 0.0 110.259 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.45 -46.83 88.43 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -57.12 -46.9 82.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.02 1.328 . . . . 0.0 111.417 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.4 t -72.69 -32.45 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 118.862 -0.59 . . . . 0.0 112.439 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.7 mt -65.33 -42.38 93.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.179 1.354 . . . . 0.0 111.291 171.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -40.36 88.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 118.732 0.696 . . . . 0.0 110.762 173.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -60.74 -52.04 66.79 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.776 0.716 . . . . 0.0 112.158 174.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -61.78 -39.96 93.51 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.532 0.605 . . . . 0.0 111.807 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -59.38 -54.51 45.89 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.915 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -51.62 -46.32 63.58 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.386 0.994 . . . . 0.0 111.458 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.37 -45.36 84.41 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.879 0.763 . . . . 0.0 111.953 -172.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -70.4 -42.52 71.55 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.37 -0.831 . . . . 0.0 111.927 178.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -58.48 -48.89 79.29 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 121.61 -0.681 . . . . 0.0 110.683 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -63.51 -40.01 95.92 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.516 1.527 . . . . 0.0 112.46 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -65.86 -29.91 70.44 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.865 0.757 . . . . 0.0 112.444 172.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.7 t -79.21 -37.53 37.94 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 171.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -149.04 105.67 3.38 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 127.892 2.477 . . . . 0.0 110.021 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.98 -11.63 25.58 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.648 3.566 . . . . 0.0 117.17 -157.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -69.1 -23.34 64.0 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -173.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 141.78 57.17 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -161.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -98.29 148.12 23.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.052 1.341 . . . . 0.0 111.983 172.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 tt -98.63 118.94 36.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.683 1.593 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -134.54 115.81 14.33 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 111.279 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.99 51.4 0.91 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.439 1.095 . . . . 0.0 113.406 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.4 t -63.89 155.54 30.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.709 160.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -56.98 -29.96 63.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.813 -1.179 . . . . 0.0 112.335 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -60.22 -41.85 93.97 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.424 -0.798 . . . . 0.0 112.53 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.29 86.98 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.679 0.792 . . . . 0.0 111.939 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.46 -48.1 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.514 175.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.88 -33.14 74.95 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.048 0.84 . . . . 0.0 112.288 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -69.3 -39.79 78.07 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.287 1.035 . . . . 0.0 113.002 174.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.0 -37.38 61.84 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -133.07 85.57 45.14 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 110.281 -168.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.84 -16.09 41.13 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.161 2.574 . . . . 0.0 114.619 -166.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 -75.2 -11.68 60.13 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 175.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.91 -26.93 49.36 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.095 0.861 . . . . 0.0 112.31 175.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 . . . . . 0 C--O 1.254 1.328 0 C-N-CA 128.272 2.629 . . . . 0.0 116.757 161.759 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.78 148.26 26.81 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.9 mt -123.75 151.08 43.64 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.86 1.664 . . . . 0.0 111.825 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -69.56 131.68 45.05 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.512 0.725 . . . . 0.0 109.88 161.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.43 -22.55 17.63 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -140.24 162.92 34.12 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.132 1.373 . . . . 0.0 112.647 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.14 -164.45 54.92 Favored Glycine 0 CA--C 1.542 1.771 0 C-N-CA 124.169 0.89 . . . . 0.0 114.463 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.67 -28.94 68.54 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 123.915 3.076 . . . . 0.0 114.646 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 79.9 mt -94.09 1.75 56.11 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.893 1.277 . . . . 0.0 113.542 -176.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.88 125.59 12.23 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.196 0.907 . . . . 0.0 112.268 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.95 -3.39 73.58 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 116.165 1.226 . . . . 0.0 116.165 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.2 mt -107.55 154.9 40.5 Favored Pre-proline 0 CA--C 1.551 1.006 0 CA-C-N 118.977 1.389 . . . . 0.0 112.566 -173.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -56.0 145.26 75.4 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.178 3.252 . . . . 0.0 113.008 176.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -79.18 -28.97 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.252 -0.28 . . . . 0.0 111.398 172.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.5 p -140.94 165.37 27.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.863 1.265 . . . . 0.0 112.262 -174.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -65.02 -27.08 68.56 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.172 -0.955 . . . . 0.0 112.694 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.3 t -69.07 -43.69 74.08 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.339 0.655 . . . . 0.0 111.444 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -61.96 -41.95 98.57 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.247 -0.908 . . . . 0.0 110.908 172.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.64 85.18 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.574 0.749 . . . . 0.0 112.693 176.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.5 -44.91 85.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.99 1.716 . . . . 0.0 111.757 174.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.26 -35.23 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.218 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.69 -45.27 93.56 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.605 1.548 . . . . 0.0 111.314 173.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.2 mt -62.52 -43.45 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 118.272 0.487 . . . . 0.0 110.471 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -59.73 -50.64 73.03 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.878 -0.514 . . . . 0.0 112.342 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -32.69 68.65 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.509 -0.744 . . . . 0.0 111.763 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.45 -48.88 73.63 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.611 0.765 . . . . 0.0 110.918 171.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.2 t90 -55.2 -44.69 75.57 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.788 170.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -65.8 -45.68 81.48 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 120.05 1.296 . . . . 0.0 112.093 -175.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.79 -46.57 88.99 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.945 -0.472 . . . . 0.0 111.695 174.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -58.05 -51.34 70.09 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.069 0.547 . . . . 0.0 111.156 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -53.7 -40.35 65.94 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.526 1.531 . . . . 0.0 111.968 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -68.53 -39.15 81.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.0 m -75.9 -29.36 58.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 175.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -154.2 105.02 2.42 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 128.732 2.813 . . . . 0.0 109.01 -162.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.67 -15.21 24.4 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.452 2.768 . . . . 0.0 116.164 -161.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -71.7 -25.29 62.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.7 tp -69.46 145.89 52.39 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -157.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -107.63 151.69 25.3 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.29 1.836 . . . . 0.0 111.994 172.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -105.11 119.49 39.17 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.678 1.591 . . . . 0.0 109.879 -176.297 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.79 120.47 18.35 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.609 1.163 . . . . 0.0 111.625 176.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.421 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.92 57.16 0.73 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.732 1.213 . . . . 0.0 112.639 -176.151 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 94.1 p -65.09 160.56 20.81 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.532 163.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -52.45 -39.21 60.8 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.203 -0.936 . . . . 0.0 111.279 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.1 -43.81 98.32 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.313 1.045 . . . . 0.0 112.546 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.76 85.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.665 1.121 . . . . 0.0 112.072 174.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.91 -47.12 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.117 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -68.04 -31.15 70.62 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.704 0.684 . . . . 0.0 112.639 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -71.22 -40.57 71.01 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.632 1.173 . . . . 0.0 112.964 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -73.42 -37.89 65.76 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.843 0.747 . . . . 0.0 112.937 174.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -130.72 85.34 55.99 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.853 1.661 . . . . 0.0 110.076 -168.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -70.41 -8.95 24.82 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.448 2.765 . . . . 0.0 114.852 -168.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -81.24 -9.31 59.8 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.67 -35.09 30.31 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.3 0.954 . . . . 0.0 113.223 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.315 0 CA-C-O 117.426 -1.273 . . . . 0.0 112.645 173.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.73 154.06 22.04 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.0 mt -125.77 148.81 48.98 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.442 1.497 . . . . 0.0 112.318 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -70.61 142.06 51.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.316 1.047 . . . . 0.0 110.503 163.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.91 -15.99 14.77 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -172.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.0 159.27 42.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.565 1.146 . . . . 0.0 113.07 -170.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.1 -162.91 52.75 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.385 0.993 . . . . 0.0 114.322 177.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.59 -24.18 74.15 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.46 2.773 . . . . 0.0 113.799 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.16 -6.22 59.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.655 1.582 . . . . 0.0 113.699 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.99 125.67 17.97 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.822 1.192 . . . . 0.0 111.99 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.68 -0.56 80.18 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 115.965 1.146 . . . . 0.0 115.965 -177.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.2 mt -106.78 153.38 40.79 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.1 1.45 . . . . 0.0 112.476 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -56.09 142.46 86.07 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.423 3.416 . . . . 0.0 113.07 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 t -77.82 -33.29 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.461 0.305 . . . . 0.0 110.937 173.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.18 164.72 26.72 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.787 1.235 . . . . 0.0 112.709 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.58 -29.19 70.48 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.119 -0.988 . . . . 0.0 112.53 173.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.8 m -68.36 -41.03 81.27 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.704 0.802 . . . . 0.0 111.292 173.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -61.68 -45.64 93.12 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.792 0.723 . . . . 0.0 110.588 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.41 86.28 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.262 0.625 . . . . 0.0 112.488 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -59.92 -42.18 93.37 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.425 1.49 . . . . 0.0 112.089 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.2 t -75.72 -33.12 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.385 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.63 -42.64 99.71 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.737 1.608 . . . . 0.0 111.331 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.5 mt -63.21 -42.78 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 122.991 0.517 . . . . 0.0 110.667 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -59.11 -47.03 86.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.659 0.663 . . . . 0.0 112.425 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -68.39 -37.46 80.39 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 111.998 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -63.17 -50.38 70.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.729 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -53.93 -43.61 69.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.765 1.166 . . . . 0.0 112.468 173.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -56.18 -50.62 70.67 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.971 1.26 . . . . 0.0 111.765 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.59 -48.03 73.7 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 178.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -56.07 -51.35 68.14 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.455 1.102 . . . . 0.0 110.632 176.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 91' ' ' LYS . 1.0 OUTLIER -56.41 -44.25 80.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.463 1.505 . . . . 0.0 111.883 176.23 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -61.91 -33.88 75.04 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.396 0.998 . . . . 0.0 112.848 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.9 m -78.68 -38.14 40.08 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -152.21 102.97 2.78 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 127.749 2.42 . . . . 0.0 109.659 -169.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.24 -14.08 25.66 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.966 3.111 . . . . 0.0 116.576 -160.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -65.83 -24.18 66.84 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.4 tp -64.62 145.03 56.77 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.78 0.718 . . . . 0.0 112.614 -165.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -102.34 150.28 23.49 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.955 1.302 . . . . 0.0 112.406 172.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.423 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.4 OUTLIER -102.38 115.94 31.6 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 109.497 -176.781 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.59 118.48 16.25 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.467 1.107 . . . . 0.0 111.842 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.423 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -156.12 54.41 0.57 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.592 1.157 . . . . 0.0 113.429 -173.054 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 t -75.07 163.35 27.67 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.594 0.758 . . . . 0.0 111.109 163.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -50.37 -39.45 46.63 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.688 1.195 . . . . 0.0 112.714 -177.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.55 -40.03 93.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.846 0.859 . . . . 0.0 112.719 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.99 88.5 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.517 0.727 . . . . 0.0 111.558 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.01 -46.64 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.346 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -68.0 -33.18 74.13 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.447 0.567 . . . . 0.0 112.342 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.9 ttt-85 -68.37 -41.17 80.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.594 0.758 . . . . 0.0 112.393 174.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.6 mtt-85 -73.44 -37.7 65.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.859 0.864 . . . . 0.0 112.785 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -134.55 88.0 30.33 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.976 1.71 . . . . 0.0 110.33 -170.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.22 -14.54 37.98 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.177 2.585 . . . . 0.0 114.672 -167.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -78.48 -6.87 56.6 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 177.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -86.1 -30.13 22.8 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 . . . . . 0 C--O 1.255 1.39 0 CA-C-N 119.342 0.974 . . . . 0.0 113.098 178.369 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.23 154.33 31.35 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.663 1.585 . . . . 0.0 113.88 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -121.81 149.58 43.13 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.457 1.503 . . . . 0.0 111.851 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -68.33 141.14 55.89 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.911 0.884 . . . . 0.0 110.487 162.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.14 -16.69 15.17 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.14 159.85 41.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.616 1.166 . . . . 0.0 112.862 -170.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.77 -164.39 53.23 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 124.248 0.928 . . . . 0.0 114.419 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.71 -24.05 74.09 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.489 2.793 . . . . 0.0 113.943 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.37 -6.14 59.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.749 1.62 . . . . 0.0 113.691 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.66 126.04 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.825 1.193 . . . . 0.0 112.037 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.22 -1.61 80.1 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 115.987 1.155 . . . . 0.0 115.987 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.8 mt -107.28 153.32 41.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 119.063 1.431 . . . . 0.0 112.238 -174.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -56.97 144.31 89.73 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 124.315 3.343 . . . . 0.0 113.043 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.7 t -78.61 -36.12 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.596 0.358 . . . . 0.0 111.493 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.5 t -140.98 166.12 25.66 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.402 1.481 . . . . 0.0 112.838 176.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -57.21 -28.96 63.32 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.409 1.484 . . . . 0.0 113.365 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.4 t -63.99 -42.07 97.32 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.371 0.668 . . . . 0.0 111.94 171.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -65.46 -45.04 85.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.173 -0.954 . . . . 0.0 110.326 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.9 89.15 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.639 0.654 . . . . 0.0 112.396 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -60.29 -47.7 84.89 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 0.0 111.676 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 74.1 t -69.35 -34.27 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.388 -0.82 . . . . 0.0 112.277 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.6 -43.65 93.11 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.505 1.502 . . . . 0.0 111.701 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.5 mt -68.0 -37.4 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 118.622 0.646 . . . . 0.0 110.893 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.93 -49.64 76.89 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.772 0.714 . . . . 0.0 111.993 171.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.78 -39.78 90.11 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.787 0.835 . . . . 0.0 111.788 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.49 -57.73 11.49 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.853 -1.07 . . . . 0.0 111.319 171.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 60.1 t90 -52.6 -46.75 67.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.127 1.33 . . . . 0.0 112.038 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -65.37 -43.32 91.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.035 0.934 . . . . 0.0 112.302 -174.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.43 -47.94 71.57 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.578 -0.701 . . . . 0.0 111.886 175.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -59.82 -44.79 93.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.57 0.748 . . . . 0.0 110.469 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.65 -35.75 80.63 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.983 1.313 . . . . 0.0 112.474 176.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -63.78 -39.08 93.4 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.341 0.973 . . . . 0.0 112.808 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -75.58 -36.27 60.39 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 175.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -149.92 103.4 3.2 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 127.637 2.375 . . . . 0.0 109.488 -170.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 -12.52 27.02 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.187 3.258 . . . . 0.0 116.632 -159.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.9 p-90 -68.93 -23.03 64.12 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.16 132.44 50.41 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -160.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -85.01 133.02 34.26 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.192 1.397 . . . . 0.0 110.601 170.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.8 tt -79.44 118.12 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.961 0.904 . . . . 0.0 108.72 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -122.07 115.38 22.38 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.49 0.716 . . . . 0.0 111.364 171.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.9 142.3 18.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.448 1.118 . . . . 0.0 112.968 164.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -152.1 171.62 17.6 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.766 2.827 . . . . 0.0 107.169 166.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -53.98 -34.1 58.86 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.612 -1.305 . . . . 0.0 112.96 -176.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.705 0.802 . . . . 0.0 112.848 171.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.5 87.74 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.851 0.861 . . . . 0.0 111.902 174.28 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.67 -44.93 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.132 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -67.92 -34.81 77.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.316 0.507 . . . . 0.0 112.069 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -65.18 -43.79 90.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.15 0.98 . . . . 0.0 112.176 175.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -74.79 -40.91 60.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.392 0.677 . . . . 0.0 112.328 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -125.99 90.28 50.6 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.859 1.664 . . . . 0.0 110.39 -172.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.04 -15.87 40.14 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.07 2.513 . . . . 0.0 114.696 -166.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -79.91 -6.89 58.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.51 -28.78 26.48 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--O 1.254 1.299 0 CA-C-N 119.202 0.91 . . . . 0.0 112.86 177.603 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.53 24.97 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 176.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.67 149.97 50.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.627 1.571 . . . . 0.0 111.815 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.77 129.62 40.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.908 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.44 -17.56 22.37 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -173.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.01 167.22 27.35 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.944 1.298 . . . . 0.0 112.942 -173.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.84 -165.95 54.74 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 124.032 0.825 . . . . 0.0 114.417 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -56.06 -28.41 69.47 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.982 3.121 . . . . 0.0 114.631 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.39 3.22 54.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 0.0 113.458 -176.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.3 125.83 11.76 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.141 0.882 . . . . 0.0 112.37 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.22 -3.27 76.1 Favored Glycine 0 CA--C 1.53 0.983 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -177.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 36.4 mt -106.14 155.27 38.8 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 119.01 1.405 . . . . 0.0 112.452 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -54.53 143.83 65.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.313 3.342 . . . . 0.0 112.585 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.8 t -78.15 -32.29 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 122.121 -0.362 . . . . 0.0 110.785 170.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -135.52 165.12 26.25 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.503 1.121 . . . . 0.0 113.422 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -58.75 -32.01 68.86 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.581 0.752 . . . . 0.0 112.821 171.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.5 m -71.17 -40.66 71.13 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.935 0.894 . . . . 0.0 111.704 174.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -62.07 -43.87 97.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.787 0.721 . . . . 0.0 110.561 172.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.83 -48.27 82.34 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.402 0.681 . . . . 0.0 111.991 177.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.4 ttm-85 -56.58 -46.07 80.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.856 1.262 . . . . 0.0 111.935 175.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 69.1 t -73.47 -34.15 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.08 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.85 -44.84 88.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 120.524 1.511 . . . . 0.0 111.427 173.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -62.18 -42.69 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.175 0.59 . . . . 0.0 110.338 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -60.93 -52.14 66.3 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -63.21 -39.6 95.09 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.332 0.653 . . . . 0.0 111.696 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.89 -52.84 63.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.144 0.578 . . . . 0.0 111.004 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -55.16 -41.53 71.96 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.18 0.9 . . . . 0.0 112.864 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -65.43 -45.03 85.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.687 1.131 . . . . 0.0 111.878 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -65.99 -43.9 86.42 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.304 -0.872 . . . . 0.0 112.336 175.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.98 -48.29 82.11 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.058 0.543 . . . . 0.0 110.491 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -59.14 -33.55 71.02 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.519 1.128 . . . . 0.0 112.166 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.67 -44.67 93.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.919 0.888 . . . . 0.0 112.985 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.1 p -86.02 -28.38 24.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -151.48 103.14 2.91 Favored Pre-proline 0 CA--C 1.557 1.226 0 C-N-CA 128.693 2.797 . . . . 0.0 109.832 -176.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.84 -13.74 24.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.94 3.093 . . . . 0.0 116.767 -160.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -67.28 -24.1 65.74 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -171.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.78 144.85 56.72 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -161.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -96.69 149.89 21.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.251 1.42 . . . . 0.0 113.167 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.19 118.4 36.44 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.785 1.634 . . . . 0.0 109.213 -178.127 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -131.53 110.61 11.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.235 1.014 . . . . 0.0 112.07 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.08 55.2 0.99 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.193 1.397 . . . . 0.0 112.674 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 92.5 p -62.14 154.96 25.65 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.169 156.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.05 -32.09 70.59 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.48 -1.387 . . . . 0.0 111.284 178.495 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -57.33 -43.73 83.61 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.578 1.151 . . . . 0.0 112.457 167.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.77 76.84 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.32 0.648 . . . . 0.0 112.652 174.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.28 -48.77 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 174.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.32 -29.53 69.12 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.437 0.562 . . . . 0.0 112.258 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -70.3 -45.19 66.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.602 1.161 . . . . 0.0 112.536 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -69.85 -37.41 76.14 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 118.658 0.663 . . . . 0.0 112.749 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -130.77 84.62 58.04 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.862 1.665 . . . . 0.0 110.475 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.25 -12.86 34.85 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.307 2.671 . . . . 0.0 114.571 -168.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -76.49 -11.56 59.9 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.21 -26.66 35.74 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 119.177 0.898 . . . . 0.0 112.818 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 128.03 2.532 . . . . 0.0 116.488 167.316 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.72 153.92 32.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.419 1.488 . . . . 0.0 114.122 171.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.42 149.88 43.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.633 1.573 . . . . 0.0 111.796 -178.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -69.05 141.43 54.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.897 0.879 . . . . 0.0 110.265 163.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.77 -17.71 15.46 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.33 160.22 40.33 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.645 1.178 . . . . 0.0 113.074 -170.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.04 -164.11 53.76 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 124.484 1.04 . . . . 0.0 114.45 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.79 -24.11 74.58 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.61 2.873 . . . . 0.0 113.812 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -6.17 59.35 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.759 1.624 . . . . 0.0 113.607 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.41 126.22 18.61 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.718 1.145 . . . . 0.0 112.23 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 -1.11 81.26 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -108.12 152.78 41.96 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-N 119.045 1.423 . . . . 0.0 112.363 -173.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.24 144.2 91.47 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 124.387 3.391 . . . . 0.0 113.23 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.8 t -80.48 -37.39 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 122.871 0.468 . . . . 0.0 111.537 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -139.05 168.92 18.76 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.356 1.462 . . . . 0.0 113.172 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -58.21 -35.06 71.09 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.753 1.221 . . . . 0.0 111.446 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -61.0 -39.95 91.66 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.264 1.026 . . . . 0.0 112.503 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -67.11 -47.01 72.42 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.534 -0.729 . . . . 0.0 110.005 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.19 -42.4 90.8 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.734 0.697 . . . . 0.0 112.524 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -58.96 -49.03 79.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.059 1.743 . . . . 0.0 111.703 172.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.11 -35.44 63.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-O 118.632 -0.699 . . . . 0.0 112.346 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.0 -48.64 79.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.069 1.304 . . . . 0.0 110.947 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.4 mt -63.01 -41.05 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.757 0.708 . . . . 0.0 110.94 176.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -55.14 37.74 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 122.957 0.503 . . . . 0.0 110.974 176.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -65.29 -36.03 82.83 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.828 -1.17 . . . . 0.0 112.682 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -56.85 -55.61 32.24 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.211 1.004 . . . . 0.0 110.935 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 56.3 t90 -51.85 -43.36 63.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.756 169.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -64.52 -46.93 80.8 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.731 1.15 . . . . 0.0 112.211 -173.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.03 -41.08 82.67 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.341 -0.849 . . . . 0.0 111.725 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.95 -50.46 73.98 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.581 -0.699 . . . . 0.0 111.098 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? -58.09 -39.9 79.76 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.607 1.963 . . . . 0.0 112.702 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -64.69 -35.79 82.17 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 118.899 0.772 . . . . 0.0 112.423 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.5 t -77.05 -37.57 54.41 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 174.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -150.52 106.98 3.11 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 128.127 2.571 . . . . 0.0 109.796 -172.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.55 -12.59 22.53 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.463 3.442 . . . . 0.0 116.919 -159.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -66.05 -25.02 66.85 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -174.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.1 tp -66.5 142.85 57.4 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -164.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -104.19 143.58 32.75 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.041 1.336 . . . . 0.0 111.949 175.352 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.42 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -93.64 119.84 33.15 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.226 1.41 . . . . 0.0 109.78 -178.561 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -135.1 120.62 19.27 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.551 1.141 . . . . 0.0 111.609 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.42 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.01 52.17 0.8 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.72 1.208 . . . . 0.0 112.876 -176.153 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.7 m -68.02 161.29 27.01 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.267 164.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -52.15 -38.52 57.84 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.991 -1.068 . . . . 0.0 113.075 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.73 -39.07 90.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.068 0.947 . . . . 0.0 112.787 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.1 -39.32 89.89 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.828 0.74 . . . . 0.0 111.485 174.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.26 -46.07 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.51 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.26 -30.09 67.05 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.479 0.581 . . . . 0.0 112.424 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -71.42 -40.24 70.56 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.748 0.819 . . . . 0.0 112.509 173.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 28.6 mmm-85 -68.93 -41.46 78.08 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.841 0.856 . . . . 0.0 112.127 173.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -136.38 90.57 17.48 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.576 1.55 . . . . 0.0 110.616 -168.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.13 -16.31 40.12 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.072 2.515 . . . . 0.0 114.795 -167.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -78.46 -6.51 55.54 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -85.95 -24.58 26.48 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 C--O 1.252 1.205 0 CA-C-N 119.76 1.164 . . . . 0.0 112.542 179.262 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.72 156.19 29.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.568 1.547 . . . . 0.0 114.262 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -128.81 149.87 50.55 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.579 1.552 . . . . 0.0 112.069 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -69.82 132.32 45.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.978 0.911 . . . . 0.0 109.977 163.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.12 -24.34 16.9 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -175.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.11 163.85 31.86 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.072 1.349 . . . . 0.0 112.519 -171.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.18 -166.21 54.77 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.08 0.847 . . . . 0.0 114.494 176.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.99 -28.7 70.3 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.043 3.162 . . . . 0.0 114.634 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.2 mt -94.93 2.8 55.44 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.981 1.312 . . . . 0.0 113.478 -176.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.77 126.68 14.41 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.198 0.908 . . . . 0.0 112.328 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.89 -3.4 77.48 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.5 mt -107.59 155.17 40.16 Favored Pre-proline 0 CA--C 1.552 1.042 0 CA-C-N 119.068 1.434 . . . . 0.0 112.599 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -55.34 144.07 73.59 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 124.333 3.355 . . . . 0.0 112.945 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.89 -32.95 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 122.147 -0.346 . . . . 0.0 110.848 172.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.0 p -133.37 164.11 27.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.899 1.28 . . . . 0.0 112.75 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -65.79 -25.78 67.4 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.912 -1.117 . . . . 0.0 112.843 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.8 t -68.27 -44.05 76.41 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.351 0.66 . . . . 0.0 111.098 170.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -59.17 -43.96 92.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.69 0.677 . . . . 0.0 110.643 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.63 84.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.495 0.718 . . . . 0.0 112.638 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -58.44 -43.82 88.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.127 0.971 . . . . 0.0 111.903 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.1 t -73.86 -31.9 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.523 179.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.7 mt -65.75 -42.57 90.75 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.659 1.572 . . . . 0.0 111.472 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -63.22 -41.79 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 118.52 0.6 . . . . 0.0 110.505 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -60.11 -50.16 74.78 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.76 -0.587 . . . . 0.0 112.312 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.83 -36.76 83.09 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 118.77 0.714 . . . . 0.0 111.952 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -59.51 -54.07 50.85 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.702 169.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -52.07 -43.65 63.95 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 119.218 0.917 . . . . 0.0 111.886 173.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.17 -48.67 79.02 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.834 0.853 . . . . 0.0 111.592 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.13 -44.59 79.45 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.539 -0.726 . . . . 0.0 112.335 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -57.33 -50.0 74.34 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.394 0.678 . . . . 0.0 110.363 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.52 -41.22 89.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.849 1.66 . . . . 0.0 112.333 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.12 -33.08 74.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.612 0.765 . . . . 0.0 112.529 174.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.5 m -82.19 -35.41 28.35 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -151.14 102.81 2.98 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 127.746 2.418 . . . . 0.0 109.732 -168.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.57 -12.8 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.241 3.294 . . . . 0.0 116.781 -158.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.2 p-90 -66.33 -25.4 66.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -172.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.0 tp -67.65 145.54 54.72 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -161.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -101.75 149.47 24.13 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.458 1.503 . . . . 0.0 112.47 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.87 116.31 32.42 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.793 1.637 . . . . 0.0 109.191 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.51 117.63 15.44 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.637 1.175 . . . . 0.0 111.309 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.59 51.19 0.76 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -66.94 159.58 28.15 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.235 0.614 . . . . 0.0 111.289 163.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -50.35 -38.37 41.81 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.809 1.244 . . . . 0.0 112.335 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -62.36 -39.26 92.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.121 0.969 . . . . 0.0 113.018 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.22 85.86 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.525 0.73 . . . . 0.0 111.611 173.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.65 -48.02 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.211 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -67.01 -31.07 71.38 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.8 0.727 . . . . 0.0 112.212 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -68.65 -42.24 78.24 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.134 0.974 . . . . 0.0 112.787 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -71.72 -42.83 66.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -130.68 81.24 68.1 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.04 1.736 . . . . 0.0 109.96 -163.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.14 -14.37 40.54 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.198 2.599 . . . . 0.0 114.528 -167.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 34.8 p-80 -74.95 -10.36 59.41 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.21 -26.87 28.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.471 1.032 . . . . 0.0 113.734 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.23 0 CA-C-N 119.231 0.923 . . . . 0.0 111.587 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.88 153.0 21.95 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -124.59 148.7 47.7 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.404 1.481 . . . . 0.0 112.021 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -69.88 141.6 53.14 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 110.327 162.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.62 -13.3 15.08 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -172.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.51 158.15 44.82 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.679 1.191 . . . . 0.0 112.893 -171.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.25 -163.0 51.45 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.431 1.015 . . . . 0.0 114.487 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.37 -24.09 73.04 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.522 2.814 . . . . 0.0 113.952 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.63 -7.13 59.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.647 1.579 . . . . 0.0 113.647 178.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.77 125.14 15.87 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.806 1.185 . . . . 0.0 112.027 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.2 -1.21 76.67 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 116.117 1.207 . . . . 0.0 116.117 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.0 mt -106.84 152.81 41.0 Favored Pre-proline 0 CA--C 1.549 0.938 0 CA-C-N 119.07 1.435 . . . . 0.0 112.452 -174.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -55.26 142.84 77.99 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 124.471 3.447 . . . . 0.0 112.866 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.3 t -78.02 -33.61 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.746 172.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.8 p -133.38 164.67 26.59 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.649 1.18 . . . . 0.0 113.185 -175.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -32.77 70.25 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.314 -0.866 . . . . 0.0 112.337 172.032 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -71.41 -38.7 71.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.929 0.892 . . . . 0.0 111.656 176.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -61.68 -45.22 94.92 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.826 0.739 . . . . 0.0 110.341 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.85 -46.84 89.0 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.223 0.609 . . . . 0.0 112.273 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -57.16 -44.8 83.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.145 1.378 . . . . 0.0 112.001 175.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.0 t -76.57 -32.34 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-O 118.563 -0.732 . . . . 0.0 112.29 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.8 mt -62.57 -44.16 97.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.417 1.462 . . . . 0.0 111.067 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.13 -40.8 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 118.658 0.663 . . . . 0.0 111.026 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -61.36 -48.64 80.36 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.68 -0.637 . . . . 0.0 112.314 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -65.17 -39.61 93.14 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.722 0.692 . . . . 0.0 111.909 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -55.87 -56.64 18.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.755 1.222 . . . . 0.0 110.667 173.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -51.44 -47.11 63.17 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 118.317 -0.849 . . . . 0.0 112.45 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.6 -47.82 79.88 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.879 1.218 . . . . 0.0 112.375 -173.216 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.0 -43.8 86.67 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.526 -0.734 . . . . 0.0 111.812 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -58.55 -52.96 63.42 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.844 -0.535 . . . . 0.0 110.998 175.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.3 tmtt? -54.73 -41.84 70.86 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.107 1.763 . . . . 0.0 112.613 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -67.6 -32.44 73.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.864 0.757 . . . . 0.0 112.806 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.3 t -78.07 -38.48 44.2 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 173.262 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -154.28 109.34 2.43 Favored Pre-proline 0 CA--C 1.554 1.108 0 C-N-CA 129.099 2.96 . . . . 0.0 109.482 -172.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.45 -13.72 22.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.182 3.255 . . . . 0.0 116.727 -160.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -67.43 -21.81 65.55 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.24 132.67 45.29 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.331 0.969 . . . . 0.0 110.81 -167.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -96.43 134.73 39.23 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.787 1.235 . . . . 0.0 112.413 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.411 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -83.16 119.14 24.15 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.88 1.272 . . . . 0.0 110.117 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -137.07 121.33 18.03 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.832 1.253 . . . . 0.0 111.579 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.411 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.2 55.55 0.76 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.638 1.175 . . . . 0.0 113.19 -177.886 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.9 t -63.82 153.27 37.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.464 158.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -54.9 -31.25 59.83 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.064 -1.022 . . . . 0.0 112.261 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.55 -41.5 94.64 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.871 0.869 . . . . 0.0 112.604 171.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.0 -37.64 88.34 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.776 0.83 . . . . 0.0 111.76 173.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -48.89 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.348 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -67.93 -30.46 69.78 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.688 0.677 . . . . 0.0 112.247 -178.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.56 -45.03 76.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.208 1.003 . . . . 0.0 112.379 172.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -71.81 -36.09 70.15 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.427 0.691 . . . . 0.0 112.771 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -133.02 84.74 47.89 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.919 1.688 . . . . 0.0 110.506 -169.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 -9.13 24.2 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.397 2.731 . . . . 0.0 114.979 -167.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 32.8 p-80 -81.44 -7.39 59.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.69 -36.97 28.1 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.273 0.942 . . . . 0.0 113.122 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.293 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.736 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -105.75 153.06 22.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.887 1.44 . . . . 0.0 114.887 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.9 mt -127.9 149.94 50.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.675 1.59 . . . . 0.0 111.977 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -70.19 131.04 43.63 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.602 0.761 . . . . 0.0 109.848 162.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.5 -25.18 17.71 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -175.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.36 164.55 29.95 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.307 1.443 . . . . 0.0 112.438 -171.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.29 -165.47 54.57 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.157 0.884 . . . . 0.0 114.542 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.33 -28.51 72.5 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 124.066 3.178 . . . . 0.0 114.648 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.0 mt -95.9 3.49 53.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.002 1.321 . . . . 0.0 113.519 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.37 126.03 12.3 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.098 0.863 . . . . 0.0 112.45 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.0 -2.96 76.58 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.79 1.186 . . . . 0.0 116.013 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.7 mt -107.49 154.66 40.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 CA-C-N 118.996 1.398 . . . . 0.0 112.657 -172.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -54.98 143.72 71.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.574 3.516 . . . . 0.0 112.925 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -79.05 -32.56 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.077 -0.389 . . . . 0.0 111.009 172.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -133.77 164.36 27.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.862 1.265 . . . . 0.0 112.491 -176.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.62 -26.58 68.46 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.914 -1.116 . . . . 0.0 112.808 172.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.2 t -68.19 -42.32 80.09 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.278 0.631 . . . . 0.0 111.169 171.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -61.25 -44.34 97.41 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.306 -0.871 . . . . 0.0 110.814 172.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.52 -47.16 87.39 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.371 0.668 . . . . 0.0 112.437 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.5 ttt-85 -58.09 -45.92 86.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.307 1.443 . . . . 0.0 111.833 175.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -74.2 -33.7 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.297 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.42 -46.34 88.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.235 1.38 . . . . 0.0 111.192 171.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 82.4 mt -61.55 -43.41 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.461 0.573 . . . . 0.0 110.798 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.62 -51.81 67.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.577 0.751 . . . . 0.0 112.267 177.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -69.09 -34.51 75.23 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.137 -0.977 . . . . 0.0 112.198 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -62.81 -50.87 69.29 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.374 0.67 . . . . 0.0 111.395 171.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 58.2 t90 -51.65 -44.58 63.05 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.043 0.838 . . . . 0.0 111.638 170.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.12 -46.38 87.55 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.396 0.998 . . . . 0.0 111.6 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -60.86 -47.99 83.85 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.566 0.747 . . . . 0.0 112.459 174.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -60.62 -51.34 69.83 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.573 -0.704 . . . . 0.0 111.201 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -62.32 -31.92 72.61 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.271 1.428 . . . . 0.0 112.914 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.5 tptt -60.96 -45.68 93.78 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.7 1.137 . . . . 0.0 112.345 165.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.1 t -77.7 -35.41 52.17 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -147.78 105.79 3.7 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 128.666 2.786 . . . . 0.0 108.946 -172.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.24 -14.28 25.66 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.901 3.067 . . . . 0.0 116.732 -157.505 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -68.47 -24.05 64.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -171.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.7 tp -68.66 140.4 55.46 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -98.13 153.95 18.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.92 1.288 . . . . 0.0 112.928 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -101.09 118.53 37.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.912 1.685 . . . . 0.0 109.329 178.539 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -135.93 119.44 16.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.492 1.117 . . . . 0.0 111.323 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' MET . . . . . 0.415 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.67 52.04 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.456 1.122 . . . . 0.0 113.377 -173.893 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.5 m -67.64 159.45 29.93 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.298 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -53.46 -37.0 62.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.094 -1.003 . . . . 0.0 112.596 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -61.86 -38.73 89.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.684 0.794 . . . . 0.0 113.06 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.59 91.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.994 0.815 . . . . 0.0 111.036 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.35 -47.69 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 119.177 -0.44 . . . . 0.0 110.464 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -67.97 -31.14 70.64 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.632 0.651 . . . . 0.0 112.568 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -70.12 -40.7 74.7 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.452 -0.78 . . . . 0.0 112.667 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -77.1 -33.49 56.93 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -133.41 83.65 48.93 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.923 1.689 . . . . 0.0 110.338 -171.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.43 -12.68 34.07 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.253 2.635 . . . . 0.0 114.563 -169.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -77.49 -7.19 55.84 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.74 -30.49 21.59 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.281 0.946 . . . . 0.0 113.41 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.227 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.0 ttm . . . . . 0 N--CA 1.495 1.816 0 CA-C-O 119.694 -0.194 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.71 138.06 21.81 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 111.387 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.64 137.11 2.15 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.903 1.239 . . . . 0.0 112.703 174.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -141.31 119.76 12.33 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.608 1.163 . . . . 0.0 111.839 -176.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -92.4 -23.77 19.08 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -174.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 t60 46.0 53.37 9.17 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.482 1.913 . . . . 0.0 114.517 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -67.91 123.96 22.04 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.386 -0.821 . . . . 0.0 111.85 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -82.53 -11.46 58.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -166.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -83.18 107.56 15.82 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.354 0.979 . . . . 0.0 110.323 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -104.29 -16.62 15.11 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -173.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.02 -141.85 23.81 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 125.054 1.311 . . . . 0.0 115.649 171.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.9 t -150.13 -57.83 0.18 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.24 1.416 . . . . 0.0 110.727 170.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 75.23 3.35 69.77 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 116.276 1.27 . . . . 0.0 116.276 170.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.45 -12.91 58.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 118.989 1.394 . . . . 0.0 114.68 -172.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.01 -13.13 59.99 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 -171.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.82 138.35 54.68 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.56 153.86 21.72 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.1 mt -125.62 149.31 48.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.405 1.482 . . . . 0.0 112.06 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.85 142.01 53.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.878 0.871 . . . . 0.0 110.557 164.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.88 -8.47 15.96 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.14 161.85 40.04 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.29 1.036 . . . . 0.0 113.548 -173.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.05 -164.82 49.66 Favored Glycine 0 CA--C 1.542 1.75 0 C-N-CA 124.3 0.952 . . . . 0.0 114.378 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.78 -24.32 71.05 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.582 2.855 . . . . 0.0 113.85 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.43 -8.09 59.63 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.907 1.683 . . . . 0.0 113.861 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.47 125.67 16.99 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.654 1.116 . . . . 0.0 111.971 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.64 -1.25 78.43 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 116.189 1.236 . . . . 0.0 116.189 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.2 mt -107.37 153.9 40.95 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.02 1.41 . . . . 0.0 112.292 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -55.6 143.15 80.23 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.231 3.287 . . . . 0.0 113.193 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -79.45 -33.39 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 122.412 0.285 . . . . 0.0 111.002 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -133.31 165.36 25.0 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.3 mtt85 -52.78 -42.19 64.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.842 1.257 . . . . 0.0 111.397 170.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.4 m -71.52 -36.76 71.15 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.838 0.855 . . . . 0.0 113.116 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -61.62 -43.94 97.92 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.917 1.235 . . . . 0.0 110.502 171.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.42 -47.61 83.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.318 0.647 . . . . 0.0 112.447 178.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -55.18 -46.47 75.8 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.096 1.358 . . . . 0.0 111.845 174.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.0 t -77.29 -31.49 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 118.404 -0.808 . . . . 0.0 112.27 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.1 mt -63.43 -43.57 97.05 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.491 1.496 . . . . 0.0 111.444 169.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.9 mt -63.43 -42.2 95.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 118.257 0.48 . . . . 0.0 110.552 174.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -60.27 -49.23 78.43 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.539 0.609 . . . . 0.0 112.619 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.83 -46.19 91.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.96 0.904 . . . . 0.0 110.676 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -59.57 -52.19 66.61 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.633 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.431 ' CH2' ' HE2' ' A' ' 91' ' ' LYS . 66.1 t90 -52.99 -43.42 66.42 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.814 1.188 . . . . 0.0 112.359 175.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -68.21 -43.32 78.28 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.226 0.921 . . . . 0.0 111.835 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -63.9 -46.62 84.03 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.337 -0.852 . . . . 0.0 112.079 174.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -56.72 -48.29 78.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.521 0.728 . . . . 0.0 110.306 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.431 ' HE2' ' CH2' ' A' ' 87' ' ' TRP . 1.2 tmmt? -56.08 -39.42 72.07 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.493 1.517 . . . . 0.0 112.501 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 mtpt -66.03 -37.6 86.3 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.888 1.222 . . . . 0.0 112.728 172.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.3 m -74.57 -39.29 62.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -153.59 104.97 2.53 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 128.387 2.675 . . . . 0.0 109.297 -170.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.53 -14.21 20.1 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.613 2.875 . . . . 0.0 116.506 -160.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.3 p-90 -66.76 -22.43 66.04 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -172.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -63.38 141.4 58.78 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.739 0.7 . . . . 0.0 112.428 -166.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -95.93 141.59 29.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.661 1.184 . . . . 0.0 111.536 174.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.405 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -91.44 117.48 29.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.752 1.221 . . . . 0.0 109.234 176.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -133.93 118.1 17.51 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.473 1.109 . . . . 0.0 111.559 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.405 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.58 57.13 0.81 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.61 1.195 . . . . 0.0 112.454 -177.577 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 98.7 p -63.11 159.15 17.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.318 162.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -52.86 -39.9 62.96 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.133 -0.98 . . . . 0.0 111.381 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.97 -40.78 96.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.329 1.052 . . . . 0.0 112.77 173.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -38.76 85.94 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.887 1.221 . . . . 0.0 111.935 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.04 -47.16 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 118.854 -0.594 . . . . 0.0 110.257 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -71.73 -27.06 62.74 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.102 0.864 . . . . 0.0 112.959 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -71.48 -40.0 70.54 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.396 1.078 . . . . 0.0 112.727 172.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -74.85 -38.44 61.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -132.86 80.8 59.96 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.959 1.704 . . . . 0.0 110.231 -168.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.37 -12.54 35.21 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.24 2.627 . . . . 0.0 114.746 -168.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -78.23 -8.65 58.6 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -78.02 -36.79 48.29 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.437 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 126.587 1.955 . . . . 0.0 115.084 170.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ttt . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 118.775 -0.631 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 59.05 -172.36 0.11 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 125.928 1.691 . . . . 0.0 113.405 -176.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.33 -177.42 52.85 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.909 1.243 . . . . 0.0 114.931 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.7 m 55.9 34.66 24.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.091 1.756 . . . . 0.0 114.313 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -60.83 -34.89 75.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -172.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.9 t60 61.29 160.01 0.05 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.819 2.048 . . . . 0.0 115.015 -171.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -147.78 145.93 28.98 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.968 1.307 . . . . 0.0 111.485 170.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -96.27 -86.14 0.32 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.428 1.091 . . . . 0.0 110.659 173.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -159.12 155.36 27.11 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.101 1.761 . . . . 0.0 110.419 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -74.83 -154.83 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.399 1.48 . . . . 0.0 111.43 174.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -153.85 166.88 32.05 Favored Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.712 -1.242 . . . . 0.0 113.872 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -143.46 162.07 36.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.918 1.687 . . . . 0.0 111.899 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.24 -147.61 47.72 Favored Glycine 0 CA--C 1.537 1.423 0 O-C-N 121.755 -0.591 . . . . 0.0 112.658 -172.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.09 143.58 54.16 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.976 -0.72 . . . . 0.0 112.512 176.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -80.83 178.35 8.45 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.778 1.231 . . . . 0.0 112.143 176.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.32 140.27 22.24 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -171.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.8 153.55 25.2 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.413 1.485 . . . . 0.0 113.916 174.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.3 mt -121.33 149.92 42.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.36 1.464 . . . . 0.0 111.512 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -67.66 140.33 56.81 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.335 0.654 . . . . 0.0 110.123 162.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.16 -17.28 15.43 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.26 159.92 41.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.661 1.184 . . . . 0.0 112.835 -170.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.82 -164.26 53.36 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.354 0.978 . . . . 0.0 114.51 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.94 -24.15 75.28 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.555 2.837 . . . . 0.0 113.949 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.89 -6.78 59.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.723 1.609 . . . . 0.0 113.553 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.43 125.54 16.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.774 1.17 . . . . 0.0 112.104 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.88 -1.34 77.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 116.126 1.21 . . . . 0.0 116.126 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.3 mt -107.34 152.82 41.39 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 119.116 1.458 . . . . 0.0 112.289 -174.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -58.19 144.33 95.59 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 124.326 3.35 . . . . 0.0 112.874 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.0 t -79.48 -36.19 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 121.91 -0.493 . . . . 0.0 111.354 177.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -141.58 168.5 19.62 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.519 1.527 . . . . 0.0 112.874 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.9 -36.09 64.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.121 1.368 . . . . 0.0 111.99 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -60.31 -40.18 89.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.731 0.813 . . . . 0.0 112.262 174.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -68.17 -46.1 71.67 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.761 -0.587 . . . . 0.0 110.277 174.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.14 88.1 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.482 0.583 . . . . 0.0 112.106 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -62.69 -48.44 79.29 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.293 1.437 . . . . 0.0 111.466 177.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 57.2 t -70.28 -32.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.125 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.48 -46.03 88.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.434 1.47 . . . . 0.0 111.655 172.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -66.28 -38.11 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 118.822 0.737 . . . . 0.0 110.9 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -61.37 -50.57 72.35 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.535 -0.728 . . . . 0.0 111.977 174.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -62.9 -36.99 85.16 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.213 0.605 . . . . 0.0 111.957 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.18 -57.23 13.97 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.869 0.868 . . . . 0.0 111.152 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -54.11 -46.08 72.03 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.041 0.837 . . . . 0.0 111.942 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.21 -46.64 79.86 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.66 0.664 . . . . 0.0 111.793 -173.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.15 -46.19 85.16 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.514 0.726 . . . . 0.0 111.615 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -58.81 -50.78 72.68 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 122.01 -0.431 . . . . 0.0 110.944 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -54.79 -40.61 69.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.025 1.33 . . . . 0.0 112.236 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -69.63 -31.46 69.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.942 0.897 . . . . 0.0 113.02 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.4 m -82.67 -31.47 28.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -149.11 104.28 3.35 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 127.779 2.432 . . . . 0.0 109.43 -169.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.47 4.42 5.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.878 3.719 . . . . 0.0 116.717 -157.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 p-90 -89.63 -23.38 21.93 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.6 tp -65.89 140.01 58.32 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -158.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -92.18 138.64 31.36 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.201 1.0 . . . . 0.0 111.606 172.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.1 tt -84.37 117.13 23.41 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.66 1.184 . . . . 0.0 108.274 175.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -123.59 112.42 17.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.777 0.831 . . . . 0.0 110.94 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -152.28 141.95 21.85 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.298 1.047 . . . . 0.0 112.49 164.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.3 t -157.79 170.1 23.12 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 128.993 2.917 . . . . 0.0 107.217 173.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -49.7 -39.28 36.39 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.12 -0.988 . . . . 0.0 112.592 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -61.39 -44.06 97.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 112.1 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.51 -39.67 94.21 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.604 0.762 . . . . 0.0 112.028 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.29 -46.58 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 122.001 -0.437 . . . . 0.0 109.969 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -71.24 -21.36 62.12 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -79.81 -42.78 23.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.872 1.269 . . . . 0.0 112.76 172.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.61 -42.37 82.53 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.664 0.665 . . . . 0.0 112.248 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -127.84 84.69 62.61 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.36 1.464 . . . . 0.0 109.952 -166.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -69.25 -11.1 30.7 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.298 2.666 . . . . 0.0 114.485 -167.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.2 p-80 -82.67 -7.4 59.65 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 175.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.08 -35.21 28.88 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.349 0.977 . . . . 0.0 112.641 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.0 ptt180 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 117.792 -1.099 . . . . 0.0 113.086 168.722 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 tpt . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 119.033 -0.508 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ptt85 -143.05 168.7 19.1 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.977 1.311 . . . . 0.0 113.341 -172.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.47 63.0 2.19 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.583 1.087 . . . . 0.0 114.795 168.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.1 p -138.35 140.54 39.51 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.854 1.262 . . . . 0.0 112.717 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -158.87 139.44 12.54 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.553 1.541 . . . . 0.0 111.475 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -145.01 132.48 20.78 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.244 1.418 . . . . 0.0 110.924 174.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -155.58 147.77 23.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.828 1.251 . . . . 0.0 112.095 173.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -153.64 151.48 29.75 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.297 1.439 . . . . 0.0 111.427 167.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -145.8 136.71 24.52 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.63 1.172 . . . . 0.0 111.547 168.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -90.08 -67.37 0.85 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.792 0.837 . . . . 0.0 112.319 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 75.33 119.76 0.11 Allowed Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.101 1.334 . . . . 0.0 113.507 -174.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.9 t -157.85 162.32 38.37 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.622 1.169 . . . . 0.0 112.656 -178.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 78.06 6.11 87.32 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 116.819 1.488 . . . . 0.0 116.819 168.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.85 129.66 38.67 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.012 1.406 . . . . 0.0 112.268 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -145.12 146.83 31.97 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.943 1.697 . . . . 0.0 111.876 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -160.6 154.56 22.8 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.338 1.055 . . . . 0.0 112.121 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -116.81 150.73 37.86 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.5 mt -123.13 149.86 43.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.843 1.657 . . . . 0.0 112.176 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -70.34 141.56 52.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.109 0.964 . . . . 0.0 110.45 162.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.07 -17.1 15.07 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -172.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.99 159.98 40.85 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.58 1.152 . . . . 0.0 112.982 -170.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.46 -163.41 53.09 Favored Glycine 0 CA--C 1.542 1.755 0 C-N-CA 124.396 0.998 . . . . 0.0 114.397 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -59.73 -24.11 74.36 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.524 2.816 . . . . 0.0 113.86 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -5.98 59.34 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.659 1.583 . . . . 0.0 113.641 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.73 17.69 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.87 1.213 . . . . 0.0 112.148 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.75 -1.15 80.76 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 115.904 1.122 . . . . 0.0 115.904 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.4 mt -107.1 153.1 41.21 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.009 1.404 . . . . 0.0 112.221 -174.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -57.08 143.91 91.54 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.311 3.341 . . . . 0.0 113.123 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.4 t -78.13 -29.46 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.308 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -139.02 166.44 24.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.584 1.154 . . . . 0.0 112.86 -173.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.42 -34.69 72.8 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.612 -0.68 . . . . 0.0 111.989 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.7 t -70.76 -39.47 73.23 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.06 0.544 . . . . 0.0 111.728 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.17 -44.66 96.11 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.367 -0.833 . . . . 0.0 110.722 171.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.26 -47.18 87.09 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.546 -0.721 . . . . 0.0 112.641 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -56.55 -47.12 80.14 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.643 . . . . 0.0 111.891 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 43.3 t -77.45 -30.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 118.342 -0.837 . . . . 0.0 112.613 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.04 -44.64 97.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.721 1.601 . . . . 0.0 111.22 169.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.53 -41.41 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.367 0.53 . . . . 0.0 110.952 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -60.29 -48.76 80.38 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.945 0.793 . . . . 0.0 112.288 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -64.71 -39.81 94.29 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 118.949 0.795 . . . . 0.0 111.989 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -58.68 -53.16 61.52 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.944 0.897 . . . . 0.0 111.146 171.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -55.56 -45.54 77.28 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.74 174.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -48.72 79.88 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.514 1.052 . . . . 0.0 111.733 -175.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.29 -49.33 77.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.027 0.531 . . . . 0.0 111.654 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -59.21 -52.49 65.47 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 119.093 -0.479 . . . . 0.0 111.144 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -51.87 -44.1 63.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.163 1.785 . . . . 0.0 112.282 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -73.3 -26.06 60.91 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -85.95 -29.49 23.54 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 169.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -151.37 105.1 2.93 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 128.387 2.675 . . . . 0.0 109.433 -168.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.2 -11.6 23.1 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 124.169 3.246 . . . . 0.0 116.583 -160.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -68.2 -25.78 65.4 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -172.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.8 tp -70.82 144.82 50.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -158.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -105.6 143.56 33.59 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.928 1.691 . . . . 0.0 111.594 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -93.31 119.31 32.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.202 1.401 . . . . 0.0 109.73 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -135.15 120.01 18.49 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.535 1.134 . . . . 0.0 111.672 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.421 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.67 50.13 0.75 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.786 1.234 . . . . 0.0 112.962 -176.649 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.0 m -66.96 161.5 24.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.683 0.793 . . . . 0.0 111.354 164.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -51.66 -39.57 58.42 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.179 -0.951 . . . . 0.0 112.99 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.7 -41.19 94.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 112.729 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.07 -38.73 91.73 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.218 0.917 . . . . 0.0 111.715 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.81 -46.95 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.289 177.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -69.98 -29.45 66.56 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -72.14 -40.23 68.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.162 0.985 . . . . 0.0 112.827 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -74.15 -41.56 61.33 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.805 0.729 . . . . 0.0 112.138 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -128.17 91.63 43.9 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.32 1.848 . . . . 0.0 110.282 -172.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.26 -14.98 35.1 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.182 2.588 . . . . 0.0 114.669 -167.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -81.23 -5.54 57.87 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.27 -29.04 21.95 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 . . . . . 0 C--O 1.256 1.403 0 CA-C-N 119.62 1.1 . . . . 0.0 112.881 178.327 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.498 1.975 0 N-CA-C 110.58 -0.156 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.04 162.59 40.09 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.938 1.295 . . . . 0.0 113.152 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -172.84 147.53 9.82 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 125.498 1.523 . . . . 0.0 112.371 174.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -152.95 174.13 14.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.68 1.192 . . . . 0.0 112.427 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 51.92 62.01 2.92 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.895 2.078 . . . . 0.0 113.109 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -117.11 101.57 8.58 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.876 1.271 . . . . 0.0 111.472 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -137.88 21.66 2.85 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.142 1.377 . . . . 0.0 113.242 -172.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -133.59 138.46 46.0 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.674 1.19 . . . . 0.0 112.066 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -156.18 166.02 34.69 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.031 1.332 . . . . 0.0 111.892 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 56.94 32.38 21.45 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.311 1.844 . . . . 0.0 115.279 168.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.82 -68.22 1.72 Allowed Glycine 0 CA--C 1.536 1.356 0 O-C-N 121.261 -0.899 . . . . 0.0 112.042 172.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.6 t 53.05 -159.57 0.13 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.669 1.588 . . . . 0.0 114.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.2 175.64 50.55 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 125.531 1.539 . . . . 0.0 115.336 177.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -143.73 47.29 1.46 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.603 1.561 . . . . 0.0 112.178 -173.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.63 -33.26 70.81 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.947 1.299 . . . . 0.0 113.025 -172.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.41 143.54 42.68 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.56 152.11 22.8 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.34 150.66 46.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.737 1.615 . . . . 0.0 112.128 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -69.72 132.16 45.7 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.745 0.818 . . . . 0.0 109.981 162.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -25.57 17.37 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.27 164.36 30.46 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.195 1.398 . . . . 0.0 112.392 -171.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.46 -166.16 54.62 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.292 0.948 . . . . 0.0 114.48 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.26 -28.64 72.53 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.033 3.156 . . . . 0.0 114.646 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.12 2.95 55.22 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.046 1.338 . . . . 0.0 113.511 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.69 127.1 15.15 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 119.133 0.879 . . . . 0.0 112.323 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.45 -3.64 79.27 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 115.953 1.141 . . . . 0.0 115.953 -177.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 mt -107.37 155.04 40.22 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 118.966 1.383 . . . . 0.0 112.56 -172.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -57.19 144.41 90.63 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.278 3.319 . . . . 0.0 113.015 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 38.2 t -80.11 -28.81 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 122.376 0.27 . . . . 0.0 111.327 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.4 p -139.15 166.08 25.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.574 1.15 . . . . 0.0 112.88 -173.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -60.79 -36.41 78.93 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 173.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.9 t -65.21 -44.87 86.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.849 0.86 . . . . 0.0 111.36 174.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -60.89 -43.55 98.31 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.469 -0.769 . . . . 0.0 111.078 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.34 81.21 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.47 -0.769 . . . . 0.0 112.634 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.5 ttt85 -61.16 -41.5 96.88 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.937 1.295 . . . . 0.0 111.893 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.31 -34.26 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.182 -0.914 . . . . 0.0 112.211 177.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 47.0 mt -61.31 -45.64 93.6 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.878 1.672 . . . . 0.0 111.355 171.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.17 -43.87 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 117.974 0.352 . . . . 0.0 110.47 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -58.62 -49.79 76.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.256 0.48 . . . . 0.0 112.12 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.31 -36.47 71.63 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.521 -0.737 . . . . 0.0 112.271 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -60.84 -50.78 72.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 118.463 -0.78 . . . . 0.0 110.728 169.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -53.18 -43.7 67.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.419 1.009 . . . . 0.0 111.665 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -63.67 -45.04 91.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 120.076 1.307 . . . . 0.0 112.237 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.1 -46.27 81.76 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.545 -0.722 . . . . 0.0 112.615 173.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -59.87 -48.09 83.09 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.592 -0.693 . . . . 0.0 110.493 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -57.34 -42.15 81.39 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.255 1.822 . . . . 0.0 111.986 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -59.55 -44.93 93.11 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.311 0.645 . . . . 0.0 112.451 170.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.7 m -77.09 -29.16 54.83 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -151.43 107.35 2.94 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 127.806 2.443 . . . . 0.0 109.312 -168.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.23 -14.48 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.826 3.017 . . . . 0.0 116.113 -160.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -70.96 -25.37 62.69 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -171.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -67.66 145.97 54.28 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -157.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -109.51 144.92 37.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.261 1.824 . . . . 0.0 111.5 173.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.46 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -98.18 122.2 41.04 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.85 1.66 . . . . 0.0 109.995 -177.199 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -137.59 120.35 16.31 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.658 1.183 . . . . 0.0 111.882 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.46 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.11 55.24 0.65 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.512 1.125 . . . . 0.0 113.385 -176.091 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.3 t -66.14 157.01 32.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.611 0.764 . . . . 0.0 110.913 161.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -54.26 -32.43 56.1 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.905 -1.122 . . . . 0.0 112.719 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.23 -41.32 96.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.062 0.945 . . . . 0.0 112.579 171.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.01 -38.22 87.92 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.601 0.76 . . . . 0.0 111.73 174.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.71 -47.14 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.302 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.76 -32.37 72.92 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.777 0.717 . . . . 0.0 112.385 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -69.02 -40.82 78.44 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.586 0.754 . . . . 0.0 112.625 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 78.6 mtt-85 -72.72 -39.32 67.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.965 0.906 . . . . 0.0 112.736 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -133.67 85.06 43.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.155 1.782 . . . . 0.0 109.979 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.97 -13.74 37.2 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.25 2.633 . . . . 0.0 114.611 -167.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -77.29 -8.86 58.32 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.78 -29.59 23.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 . . . . . 0 C--O 1.254 1.316 0 CA-C-N 119.42 1.009 . . . . 0.0 112.94 179.002 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 120.348 0.118 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -142.1 161.2 38.59 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.551 1.54 . . . . 0.0 112.673 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.03 158.96 23.92 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.992 1.758 . . . . 0.0 114.766 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.1 m -96.33 171.82 8.34 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.614 1.566 . . . . 0.0 112.627 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 -119.16 4.06 11.35 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -62.62 -29.93 70.97 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -162.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -66.78 134.87 53.03 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.529 0.732 . . . . 0.0 112.401 -178.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -148.92 163.49 37.32 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.616 1.566 . . . . 0.0 111.897 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -153.88 154.08 33.23 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.619 1.168 . . . . 0.0 111.698 173.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -92.34 -31.58 15.3 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.277 1.031 . . . . 0.0 113.655 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.33 147.43 42.44 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 123.876 0.75 . . . . 0.0 113.899 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.2 t -161.77 166.48 26.45 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.808 1.643 . . . . 0.0 111.286 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -175.3 159.22 27.21 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.724 -0.61 . . . . 0.0 114.578 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -108.81 23.0 15.18 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.88 1.672 . . . . 0.0 113.46 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 pp -73.28 -11.02 60.35 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -171.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.41 140.56 58.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.201 1.0 . . . . 0.0 112.882 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -103.95 150.54 24.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.98 148.83 45.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.488 1.515 . . . . 0.0 112.02 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.62 142.05 53.56 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.057 0.943 . . . . 0.0 110.462 162.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.0 -15.57 15.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -137.95 158.64 43.92 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.462 1.105 . . . . 0.0 113.388 -169.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.79 -161.93 51.19 Favored Glycine 0 CA--C 1.542 1.724 0 C-N-CA 124.494 1.045 . . . . 0.0 114.411 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.16 -24.33 73.36 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.441 2.761 . . . . 0.0 113.91 179.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.78 -6.85 59.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.541 1.537 . . . . 0.0 113.523 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 125.09 16.05 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.007 1.276 . . . . 0.0 112.056 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.89 -0.5 79.47 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 116.121 1.208 . . . . 0.0 116.121 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 27.7 mt -106.56 152.96 40.86 Favored Pre-proline 0 CA--C 1.55 0.963 0 CA-C-N 118.924 1.362 . . . . 0.0 112.284 -174.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -56.97 143.42 92.44 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.505 3.47 . . . . 0.0 112.952 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.1 t -77.96 -39.33 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.899 -0.5 . . . . 0.0 111.452 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.1 t -134.67 164.15 28.17 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.254 1.422 . . . . 0.0 112.678 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -59.97 -27.23 66.66 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.003 -1.061 . . . . 0.0 112.833 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.5 m -68.86 -35.34 76.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 171.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -65.17 -44.56 88.08 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.257 0.935 . . . . 0.0 109.736 169.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.99 93.37 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 -56.32 -48.54 76.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.822 1.649 . . . . 0.0 111.502 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.5 t -73.89 -33.45 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 118.546 -0.74 . . . . 0.0 112.186 -178.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.13 -47.97 82.2 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 120.262 1.392 . . . . 0.0 111.1 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.77 -43.37 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 122.885 0.474 . . . . 0.0 110.789 175.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -59.5 -52.47 65.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.747 0.819 . . . . 0.0 112.41 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -68.56 -34.65 76.2 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.678 -0.639 . . . . 0.0 112.337 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -61.47 -53.21 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.14 170.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -52.17 -45.74 65.23 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.359 172.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -64.87 -42.1 95.13 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.646 1.112 . . . . 0.0 112.679 -175.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -62.97 -47.98 80.84 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.896 0.771 . . . . 0.0 111.506 173.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.0 mmp_? -59.66 -50.84 72.3 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.715 -0.616 . . . . 0.0 110.918 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -52.46 -41.34 63.23 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.596 1.959 . . . . 0.0 112.6 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -67.59 -36.73 81.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.116 . . . . 0.0 111.874 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 t -79.49 -33.23 42.36 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 176.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -152.98 112.14 2.69 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 128.427 2.691 . . . . 0.0 109.669 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.94 -11.64 18.0 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 124.34 3.36 . . . . 0.0 116.401 -161.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -66.74 -24.84 66.28 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -172.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.91 144.16 49.07 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -159.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -103.04 147.94 26.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.048 1.739 . . . . 0.0 112.174 171.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.417 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -98.97 118.24 35.29 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.543 1.537 . . . . 0.0 109.26 -179.709 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -134.34 115.35 13.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.38 1.072 . . . . 0.0 111.922 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.417 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.13 49.43 0.78 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.84 1.256 . . . . 0.0 112.997 -175.369 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.1 t -64.21 156.31 29.11 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.809 162.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -50.28 -36.89 33.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.447 1.099 . . . . 0.0 112.029 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -61.74 -42.45 98.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.137 0.975 . . . . 0.0 112.251 174.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.04 89.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.695 0.679 . . . . 0.0 111.49 174.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.4 -45.74 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.996 -0.44 . . . . 0.0 110.342 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -68.01 -31.49 71.21 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -72.1 -40.26 68.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.281 1.032 . . . . 0.0 112.835 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -74.31 -37.28 63.67 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.754 0.822 . . . . 0.0 112.802 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -132.95 88.59 36.71 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.857 1.663 . . . . 0.0 110.205 -170.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -70.21 -10.56 28.48 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.329 2.686 . . . . 0.0 114.819 -166.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -82.81 -6.61 59.51 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.64 -32.45 23.66 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.365 0.984 . . . . 0.0 113.217 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 . . . . . 0 C--O 1.256 1.395 0 C-N-CA 123.839 0.856 . . . . 0.0 113.127 169.54 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 120.044 -0.027 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -70.5 157.44 37.86 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.402 1.081 . . . . 0.0 112.586 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.88 109.05 0.65 Allowed Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.501 1.524 . . . . 0.0 112.634 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 t -86.2 -28.29 23.98 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.007 0.923 . . . . 0.0 113.372 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.7 166.95 21.82 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -73.33 129.88 38.97 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.579 0.751 . . . . 0.0 112.023 174.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -89.35 89.64 7.97 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.601 1.16 . . . . 0.0 109.907 172.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 53.34 37.92 26.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.552 1.541 . . . . 0.0 113.662 -175.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 63.76 117.06 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 128.318 2.647 . . . . 0.0 114.362 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.2 m170 -74.14 -22.35 59.49 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -172.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.65 -160.99 53.91 Favored Glycine 0 CA--C 1.538 1.473 0 CA-C-N 118.902 0.774 . . . . 0.0 113.898 -170.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.6 p -143.67 163.03 34.41 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.322 1.449 . . . . 0.0 112.454 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -79.03 -163.32 25.03 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.704 1.145 . . . . 0.0 114.625 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.38 51.9 0.74 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.855 1.662 . . . . 0.0 113.226 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.7 tp -75.21 -30.13 60.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.056 1.742 . . . . 0.0 112.383 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.36 142.3 50.38 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.636 -0.665 . . . . 0.0 112.693 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.49 152.63 23.41 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -124.14 150.43 45.12 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.582 1.553 . . . . 0.0 111.83 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -68.34 131.66 45.71 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.543 0.737 . . . . 0.0 110.182 164.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.3 -18.4 22.49 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.49 167.49 27.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 112.904 -173.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.62 -168.86 54.81 Favored Glycine 0 CA--C 1.542 1.73 0 C-N-CA 124.105 0.86 . . . . 0.0 114.571 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.6 -28.51 75.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.166 3.244 . . . . 0.0 114.542 -174.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.3 mt -95.47 3.76 53.93 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.996 1.318 . . . . 0.0 113.507 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.29 128.94 17.79 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.941 0.791 . . . . 0.0 112.489 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.59 -5.25 82.46 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 -176.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.5 mt -106.82 155.97 38.11 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 118.919 1.359 . . . . 0.0 112.166 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -56.89 142.31 93.04 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.099 3.199 . . . . 0.0 112.88 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -78.35 -32.05 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.91 174.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -134.23 166.52 22.59 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.468 1.107 . . . . 0.0 113.304 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -62.74 -36.24 82.39 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.436 -0.79 . . . . 0.0 111.269 173.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -65.23 -41.34 94.47 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.064 0.946 . . . . 0.0 111.823 173.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -60.54 -46.0 91.79 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.878 0.763 . . . . 0.0 110.452 172.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.1 91.5 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -57.35 -46.55 83.19 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.711 1.204 . . . . 0.0 111.218 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.5 t -73.15 -32.45 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.717 0.807 . . . . 0.0 112.428 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.4 mt -62.15 -47.19 85.64 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 120.27 1.395 . . . . 0.0 110.955 170.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.05 -41.24 92.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 118.833 0.742 . . . . 0.0 110.675 176.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -59.85 -51.22 70.66 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -66.85 -39.76 87.69 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.698 -0.626 . . . . 0.0 111.521 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -56.99 -52.74 64.04 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.821 0.848 . . . . 0.0 111.201 172.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -52.52 -45.24 66.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.298 -0.858 . . . . 0.0 112.12 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -68.88 -40.67 79.09 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.717 1.144 . . . . 0.0 112.8 -174.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.72 -45.47 89.8 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.212 -0.93 . . . . 0.0 112.004 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -58.37 -52.1 67.03 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.763 -0.586 . . . . 0.0 110.653 174.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.46 -40.61 51.26 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 126.432 1.893 . . . . 0.0 112.509 173.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -69.63 -34.23 73.75 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.076 0.95 . . . . 0.0 111.771 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.0 t -78.44 -37.89 42.58 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 173.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -153.47 108.73 2.58 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.797 2.839 . . . . 0.0 109.584 -171.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 -13.87 18.35 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.007 3.138 . . . . 0.0 116.656 -160.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -65.09 -25.33 67.75 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.294 1.591 . . . . 0.0 115.294 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 34.0 tp -65.61 142.89 57.91 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -162.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 68.7 mtp85 -87.04 148.06 25.44 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.505 1.122 . . . . 0.0 113.163 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.31 108.25 19.83 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.852 1.261 . . . . 0.0 108.754 167.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -132.31 122.92 25.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.819 1.248 . . . . 0.0 110.005 173.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.83 64.21 0.79 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -175.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -65.63 162.87 17.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.076 0.95 . . . . 0.0 112.155 166.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -53.96 -36.5 62.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.849 -1.157 . . . . 0.0 111.784 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -62.77 -40.97 98.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.974 0.91 . . . . 0.0 112.402 172.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.27 91.27 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.639 1.109 . . . . 0.0 112.059 172.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -47.3 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.143 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -69.15 -30.93 69.27 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.018 0.826 . . . . 0.0 112.491 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -70.33 -37.77 74.76 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.296 1.038 . . . . 0.0 112.943 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.9 -42.73 63.27 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 119.042 0.837 . . . . 0.0 112.816 169.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -132.33 84.16 52.82 Favored Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 125.814 1.646 . . . . 0.0 110.131 -163.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.6 -14.95 40.68 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.245 2.63 . . . . 0.0 114.506 -166.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -77.17 -8.28 57.27 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.84 -21.43 23.71 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 . . . . . 0 C--O 1.253 1.282 0 CA-C-N 119.871 1.214 . . . . 0.0 112.451 175.692 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.498 1.933 0 CA-C-O 119.99 -0.053 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 51.19 50.56 18.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 126.151 1.78 . . . . 0.0 113.917 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -162.28 -159.77 10.53 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.079 1.323 . . . . 0.0 113.604 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 t 58.92 -165.89 0.18 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.597 1.559 . . . . 0.0 113.737 -174.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 55.83 43.7 27.21 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.532 1.933 . . . . 0.0 113.384 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -80.67 144.49 32.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.479 1.112 . . . . 0.0 111.874 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -137.97 156.47 47.82 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.482 1.513 . . . . 0.0 111.877 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -107.99 127.78 54.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.672 1.189 . . . . 0.0 111.422 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -94.62 9.15 39.86 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -169.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -66.64 147.64 52.99 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 169.04 179.74 41.26 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.939 1.733 . . . . 0.0 112.132 -176.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.0 p -153.97 150.51 28.39 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -73.34 140.42 28.35 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.063 0.84 . . . . 0.0 113.27 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -153.26 167.26 29.92 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.676 1.59 . . . . 0.0 111.83 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 pp -130.43 149.8 51.94 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.259 1.424 . . . . 0.0 114.303 -174.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -153.71 151.81 30.06 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.7 1.2 . . . . 0.0 112.384 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.48 154.47 32.46 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 114.538 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -126.05 149.13 49.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 112.085 -177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -70.64 142.38 51.63 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.025 0.93 . . . . 0.0 110.485 162.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.67 -14.14 14.88 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.55 158.23 44.64 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.596 1.159 . . . . 0.0 113.034 -171.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.38 -162.86 51.72 Favored Glycine 0 CA--C 1.54 1.638 0 C-N-CA 124.373 0.987 . . . . 0.0 114.442 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.3 -24.42 74.21 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.627 2.885 . . . . 0.0 113.871 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.25 -7.38 59.61 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.638 1.575 . . . . 0.0 113.68 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.41 16.88 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.796 1.18 . . . . 0.0 112.061 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.14 -0.76 79.1 Favored Glycine 0 CA--C 1.53 1.01 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.11 153.55 40.95 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 119.002 1.401 . . . . 0.0 112.144 -174.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -56.16 142.84 86.28 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 124.327 3.351 . . . . 0.0 113.071 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.2 t -77.32 -33.76 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.746 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.9 p -133.84 164.45 27.22 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.614 1.166 . . . . 0.0 113.274 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -60.57 -31.28 70.41 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.332 -0.855 . . . . 0.0 112.685 172.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.6 m -69.42 -41.42 76.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.66 173.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.25 -45.05 96.14 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.708 0.685 . . . . 0.0 110.463 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.62 85.34 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.507 0.723 . . . . 0.0 112.251 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -56.64 -45.62 81.49 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.885 1.274 . . . . 0.0 111.797 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.33 -33.87 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.532 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.85 -44.08 97.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.409 1.458 . . . . 0.0 111.193 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.43 -42.49 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.528 0.603 . . . . 0.0 110.8 174.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -60.57 -50.15 74.67 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.79 -0.569 . . . . 0.0 112.286 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -69.09 -35.1 76.1 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.571 -0.706 . . . . 0.0 112.234 -177.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.55 -56.24 23.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.262 1.025 . . . . 0.0 110.541 169.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -52.87 -45.61 67.51 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.911 173.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -67.42 -41.75 84.31 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.344 0.975 . . . . 0.0 112.238 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.49 -43.98 79.64 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.214 -0.929 . . . . 0.0 111.611 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.6 -49.56 76.01 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.654 -0.654 . . . . 0.0 110.759 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -54.96 -43.05 73.11 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.396 1.878 . . . . 0.0 112.453 175.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -63.33 -36.99 85.53 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.675 0.79 . . . . 0.0 112.146 175.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.6 m -77.64 -36.71 51.22 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -152.93 103.99 2.65 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 128.094 2.558 . . . . 0.0 109.788 -168.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.67 -13.32 22.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.095 3.197 . . . . 0.0 116.679 -160.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -65.5 -24.2 67.08 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -172.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.64 146.61 54.6 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -163.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -100.42 150.95 22.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.252 1.421 . . . . 0.0 113.232 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.409 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -109.37 117.87 35.17 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.791 1.636 . . . . 0.0 109.535 -177.451 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.29 120.48 18.9 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.555 1.142 . . . . 0.0 111.613 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.409 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -151.51 53.08 0.83 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.589 1.156 . . . . 0.0 113.043 -176.128 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.8 t -67.8 157.09 35.57 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.785 160.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -54.3 -31.6 54.44 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.853 -1.154 . . . . 0.0 112.781 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -61.52 -41.54 97.48 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 112.036 172.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.95 -38.73 89.36 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.798 0.839 . . . . 0.0 111.849 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.61 -47.44 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.318 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -67.92 -32.59 73.15 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.624 0.647 . . . . 0.0 112.264 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -69.8 -39.24 76.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.626 -0.672 . . . . 0.0 112.601 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 -71.82 -41.95 67.61 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.694 0.679 . . . . 0.0 112.649 172.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.77 83.31 61.95 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.701 1.601 . . . . 0.0 110.133 -165.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.35 -14.66 40.73 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 -166.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.7 p-80 -77.49 -8.32 57.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.52 -29.56 25.85 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.489 1.04 . . . . 0.0 113.593 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.066 0.947 . . . . 0.0 112.741 177.509 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -146.59 150.19 35.02 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.471 1.508 . . . . 0.0 111.444 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.66 -175.43 54.91 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.624 1.106 . . . . 0.0 114.539 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.4 t -150.58 49.9 0.88 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.836 1.654 . . . . 0.0 110.212 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -119.36 32.71 5.96 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.663 1.585 . . . . 0.0 112.95 -163.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -125.77 155.48 40.97 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.13 1.772 . . . . 0.0 112.11 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -142.5 145.71 33.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.317 1.447 . . . . 0.0 112.109 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -149.32 147.09 27.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.434 1.493 . . . . 0.0 111.491 177.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -147.17 150.66 35.37 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.962 1.305 . . . . 0.0 112.131 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.497 ' CG ' ' H ' ' A' ' 11' ' ' GLY . 18.9 t-80 52.57 -154.2 0.21 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.135 1.774 . . . . 0.0 112.918 -179.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.497 ' H ' ' CG ' ' A' ' 10' ' ' HIS . . . 176.27 166.03 32.91 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.662 -1.274 . . . . 0.0 114.54 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 m -64.89 141.46 58.77 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.471 1.109 . . . . 0.0 112.976 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.38 26.48 0.21 Allowed Glycine 0 CA--C 1.535 1.334 0 N-CA-C 115.187 0.835 . . . . 0.0 115.187 -177.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.48 102.46 6.91 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.271 1.036 . . . . 0.0 111.489 -177.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 pp -81.39 -12.34 58.99 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.92 148.64 49.03 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.411 1.085 . . . . 0.0 113.186 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -100.4 140.84 34.08 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 174.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.48 152.06 50.14 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.614 1.566 . . . . 0.0 112.219 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -68.11 145.39 54.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.455 1.502 . . . . 0.0 111.343 175.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.2 -13.79 14.84 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -138.76 158.96 43.26 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.568 1.147 . . . . 0.0 112.93 -171.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.19 -164.09 52.3 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 124.396 0.998 . . . . 0.0 114.436 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.98 -23.79 74.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.404 2.736 . . . . 0.0 113.844 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mp -84.27 -5.66 59.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.532 1.533 . . . . 0.0 113.76 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.91 127.28 23.13 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.992 1.269 . . . . 0.0 112.147 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.28 -7.67 80.2 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.724 1.154 . . . . 0.0 115.698 -176.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.7 mt -104.43 149.65 37.61 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 118.893 1.347 . . . . 0.0 112.058 -170.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -58.76 146.43 92.59 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 124.371 3.381 . . . . 0.0 113.019 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.85 -28.63 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.397 175.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 p -140.3 167.2 22.69 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.468 1.107 . . . . 0.0 112.823 -172.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -65.61 -33.94 77.07 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.854 0.862 . . . . 0.0 111.772 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.8 t -69.05 -42.03 76.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.561 0.744 . . . . 0.0 111.83 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -64.6 -38.46 91.07 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.502 -0.749 . . . . 0.0 111.466 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.65 -46.37 90.05 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.45 -0.781 . . . . 0.0 112.419 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -56.1 -44.49 79.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.232 1.413 . . . . 0.0 112.016 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.03 -35.44 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-O 118.4 -0.809 . . . . 0.0 112.149 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.33 -44.18 97.08 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.616 1.553 . . . . 0.0 111.361 172.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.76 -40.94 90.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 118.286 0.494 . . . . 0.0 110.863 174.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.94 -46.69 88.22 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.563 -0.711 . . . . 0.0 112.578 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.17 -38.37 90.34 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.496 0.719 . . . . 0.0 111.632 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -59.65 -55.85 29.3 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.005 169.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -54.14 -42.11 69.18 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.605 1.093 . . . . 0.0 112.692 177.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.96 -49.44 77.69 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.767 1.167 . . . . 0.0 112.649 175.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.92 -49.61 77.03 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.276 -0.89 . . . . 0.0 111.489 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmt-85 -61.22 -49.37 77.4 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.984 0.913 . . . . 0.0 110.372 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.36 -38.12 79.62 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.188 1.395 . . . . 0.0 112.565 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -66.12 -37.49 85.85 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.088 0.858 . . . . 0.0 112.311 173.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.1 m -76.81 -36.78 56.69 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -153.49 104.38 2.55 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 128.174 2.59 . . . . 0.0 109.617 -168.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.88 -13.01 24.16 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.041 3.16 . . . . 0.0 116.65 -160.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -67.94 -24.12 65.14 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -171.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -65.25 143.1 58.03 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -161.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -93.37 147.37 22.99 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.901 1.28 . . . . 0.0 111.862 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.82 118.03 36.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.497 1.519 . . . . 0.0 109.276 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.6 115.53 14.79 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.404 1.082 . . . . 0.0 111.721 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.68 49.43 0.87 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.809 1.244 . . . . 0.0 112.973 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.3 t -64.6 157.08 27.98 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.72 160.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -51.7 -38.97 57.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.212 1.005 . . . . 0.0 112.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -62.65 -37.04 84.8 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.854 0.862 . . . . 0.0 113.091 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.28 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 118.933 0.788 . . . . 0.0 111.417 173.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.53 -47.61 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.151 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -69.31 -29.56 67.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.846 0.748 . . . . 0.0 112.269 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -74.4 -36.14 63.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 175.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -78.25 -39.7 39.44 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.266 0.939 . . . . 0.0 111.967 174.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -127.36 90.29 49.18 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.313 1.845 . . . . 0.0 110.329 -172.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -71.28 -12.68 30.21 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.204 2.603 . . . . 0.0 115.086 -165.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -82.68 -5.07 58.66 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.77 -19.68 28.72 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-N 119.904 1.229 . . . . 0.0 111.167 165.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mmt . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 119.948 -0.072 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -146.7 141.02 26.38 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.184 1.393 . . . . 0.0 111.35 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.3 -164.22 35.87 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.815 1.198 . . . . 0.0 114.026 176.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.1 m -128.6 144.59 51.18 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.935 1.294 . . . . 0.0 111.325 175.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -91.35 122.26 33.8 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.489 1.115 . . . . 0.0 111.739 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -149.06 146.24 27.64 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.605 1.562 . . . . 0.0 111.486 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -154.22 117.05 4.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.39 1.476 . . . . 0.0 110.124 170.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -135.7 6.87 3.23 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -62.33 125.97 25.73 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.217 -0.927 . . . . 0.0 112.486 -171.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -157.37 157.1 33.43 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.405 1.482 . . . . 0.0 111.662 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 76.48 167.97 26.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.1 1.333 . . . . 0.0 114.93 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -154.9 153.74 31.57 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.142 1.377 . . . . 0.0 112.647 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 78.55 131.22 0.66 Allowed Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.349 1.452 . . . . 0.0 114.754 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 49.43 41.73 21.3 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.826 1.65 . . . . 0.0 114.766 175.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.38 -43.72 88.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.493 1.117 . . . . 0.0 113.778 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.77 148.88 29.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.247 1.019 . . . . 0.0 112.254 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.82 153.98 33.62 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.284 1.434 . . . . 0.0 114.423 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.6 mt -124.41 149.2 46.99 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.411 1.484 . . . . 0.0 111.884 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.31 140.35 54.35 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.806 0.842 . . . . 0.0 110.182 162.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.9 -16.96 15.21 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.08 159.87 41.14 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.749 1.22 . . . . 0.0 112.959 -170.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.92 -164.1 53.59 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 124.335 0.969 . . . . 0.0 114.37 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.89 -24.15 75.14 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.611 2.874 . . . . 0.0 113.829 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -84.38 -6.19 59.36 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.826 1.65 . . . . 0.0 113.528 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.61 125.82 17.74 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 119.841 1.201 . . . . 0.0 112.13 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.35 -1.23 79.21 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 116.003 1.161 . . . . 0.0 116.003 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.5 mt -106.82 153.14 40.97 Favored Pre-proline 0 CA--C 1.55 0.957 0 CA-C-N 119.08 1.44 . . . . 0.0 112.382 -174.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -55.37 141.54 81.52 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 124.364 3.376 . . . . 0.0 112.901 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 t -76.44 -33.76 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.285 -0.259 . . . . 0.0 110.886 172.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.65 166.47 22.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.823 1.249 . . . . 0.0 113.015 -174.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -33.43 74.27 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.295 -0.878 . . . . 0.0 111.62 172.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.2 m -66.11 -40.11 90.48 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.48 0.712 . . . . 0.0 111.534 174.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -63.0 -45.63 91.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.771 0.714 . . . . 0.0 110.621 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.58 89.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.723 0.692 . . . . 0.0 112.386 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -54.18 -49.74 68.64 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.026 1.73 . . . . 0.0 111.254 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.25 -31.33 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.426 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.5 -47.44 83.96 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.431 1.469 . . . . 0.0 111.258 170.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.3 mt -62.14 -43.32 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.532 0.605 . . . . 0.0 110.69 175.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.37 -50.95 71.57 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.538 0.735 . . . . 0.0 112.325 177.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -69.04 -33.76 74.1 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.537 -0.727 . . . . 0.0 112.071 -177.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -60.43 -54.71 42.35 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.663 0.785 . . . . 0.0 110.86 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 64.0 t90 -49.83 -47.01 51.8 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.306 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -64.02 -46.46 84.38 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 120.113 1.324 . . . . 0.0 112.131 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.6 -45.59 89.63 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.555 -0.716 . . . . 0.0 111.894 175.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -57.33 -49.45 76.08 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.875 -0.516 . . . . 0.0 110.633 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt -55.62 -41.0 72.89 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.617 1.567 . . . . 0.0 112.183 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -65.76 -39.31 90.91 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -77.87 -32.75 52.15 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -155.44 111.32 2.23 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 128.288 2.635 . . . . 0.0 109.393 -166.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -75.59 -11.95 20.4 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 124.016 3.144 . . . . 0.0 116.359 -160.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.4 p-90 -67.82 -30.73 70.21 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -171.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.1 tt -72.36 141.57 48.77 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.487 0.715 . . . . 0.0 111.768 -156.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -114.55 142.23 46.7 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.357 1.463 . . . . 0.0 111.887 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.408 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -90.15 119.86 30.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.036 1.334 . . . . 0.0 110.304 -172.325 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.85 120.32 18.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.636 1.174 . . . . 0.0 111.741 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.408 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -150.19 54.76 0.92 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.962 1.305 . . . . 0.0 112.441 -177.478 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -63.79 163.41 11.76 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.346 1.058 . . . . 0.0 112.185 165.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -50.23 -44.0 53.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.996 0.919 . . . . 0.0 111.041 173.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -61.01 -44.36 97.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.466 1.106 . . . . 0.0 112.292 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -39.53 87.68 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.381 0.991 . . . . 0.0 112.464 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.69 -48.16 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.072 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -69.34 -27.17 65.12 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.815 0.734 . . . . 0.0 112.764 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -72.96 -42.02 63.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.661 1.184 . . . . 0.0 112.691 172.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.1 mtt85 -73.14 -37.42 66.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -134.84 82.63 43.26 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 126.067 1.747 . . . . 0.0 110.168 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.63 -12.13 33.81 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.32 2.68 . . . . 0.0 114.679 -168.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -79.05 -7.87 58.48 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.65 -31.14 26.34 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.611 1.096 . . . . 0.0 113.304 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 . . . . . 0 C--O 1.256 1.407 0 CA-C-N 119.386 0.994 . . . . 0.0 111.887 168.776 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.8 mtm . . . . . 0 N--CA 1.501 2.089 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -153.42 169.78 22.31 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.811 1.244 . . . . 0.0 113.528 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.58 -3.7 71.93 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 164.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.7 m -82.82 114.27 21.02 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.257 1.529 . . . . 0.0 111.971 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -97.01 141.53 30.05 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.239 1.016 . . . . 0.0 112.75 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -155.38 156.17 34.92 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.062 1.345 . . . . 0.0 110.442 162.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.8 p-80 -147.29 135.53 21.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.296 172.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -154.98 158.0 38.53 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.507 1.123 . . . . 0.0 111.494 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -153.64 122.75 6.5 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.566 1.546 . . . . 0.0 109.978 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.8 t-80 -155.81 157.36 36.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.262 1.025 . . . . 0.0 112.634 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 85.36 155.06 24.0 Favored Glycine 0 CA--C 1.537 1.466 0 C-N-CA 125.283 1.421 . . . . 0.0 114.859 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -153.75 170.26 21.36 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.958 1.703 . . . . 0.0 111.995 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 60.75 -120.92 24.87 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.044 0.83 . . . . 0.0 113.401 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.84 -10.76 60.24 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 55.38 -160.71 0.18 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.889 1.676 . . . . 0.0 113.915 -177.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.69 141.23 57.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -176.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.34 156.39 18.56 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -128.09 148.58 50.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -71.29 141.77 50.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.127 0.971 . . . . 0.0 110.412 163.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.59 -15.15 14.85 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.69 158.95 43.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.625 1.17 . . . . 0.0 113.087 -170.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.63 -162.84 52.08 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.444 1.021 . . . . 0.0 114.396 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.44 -24.04 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.469 2.779 . . . . 0.0 113.839 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.08 -6.61 59.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.723 1.609 . . . . 0.0 113.64 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.2 16.19 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.934 1.243 . . . . 0.0 112.029 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.26 -0.44 78.27 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 115.971 1.148 . . . . 0.0 115.971 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.7 mt -106.51 153.05 40.8 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 119.07 1.435 . . . . 0.0 112.537 -174.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -54.7 144.04 66.88 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.575 3.516 . . . . 0.0 113.213 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.7 t -80.91 -33.9 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 122.651 0.38 . . . . 0.0 110.896 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -130.97 165.77 22.43 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.763 1.225 . . . . 0.0 113.309 -175.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -62.82 -35.33 79.57 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.375 -0.828 . . . . 0.0 111.05 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.3 m -65.12 -41.46 94.86 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.157 0.983 . . . . 0.0 111.893 173.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -61.17 -46.39 90.68 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.957 0.799 . . . . 0.0 110.486 173.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.73 88.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.348 0.659 . . . . 0.0 112.51 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -61.57 -42.56 99.03 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.295 1.438 . . . . 0.0 112.099 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 67.6 t -73.83 -34.51 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.466 176.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.89 -44.21 96.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 120.492 1.496 . . . . 0.0 111.287 172.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.26 -42.99 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.214 0.461 . . . . 0.0 110.815 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -57.89 -52.81 63.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.744 0.702 . . . . 0.0 112.179 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -63.14 -41.17 99.24 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.719 0.69 . . . . 0.0 112.093 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.09 -51.21 71.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.989 0.516 . . . . 0.0 111.062 175.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.23 -45.36 72.28 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.915 171.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.12 -46.64 83.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.034 1.288 . . . . 0.0 112.204 -173.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -65.73 -42.84 90.57 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.443 -0.785 . . . . 0.0 111.882 176.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -60.4 -50.02 75.27 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.673 -0.642 . . . . 0.0 111.193 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -55.22 -40.85 71.31 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.972 1.709 . . . . 0.0 112.03 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -64.98 -40.17 94.58 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.59 0.756 . . . . 0.0 112.697 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.5 m -80.62 -29.31 36.81 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -150.98 110.15 3.07 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 128.225 2.61 . . . . 0.0 109.254 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.1 -11.52 21.3 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.765 2.977 . . . . 0.0 116.115 -161.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.7 p-90 -76.73 -19.94 57.1 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -170.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.33 147.85 45.91 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.455 1.025 . . . . 0.0 113.452 -164.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -114.02 149.66 35.07 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 125.124 1.37 . . . . 0.0 112.189 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.451 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -94.22 121.08 35.36 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.61 1.564 . . . . 0.0 109.681 -175.209 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -137.55 112.4 8.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.196 0.999 . . . . 0.0 111.945 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.451 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -149.47 51.69 0.94 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.833 1.253 . . . . 0.0 113.099 -177.025 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 t -66.2 157.34 31.65 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.74 160.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -52.71 -36.9 58.23 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.145 0.978 . . . . 0.0 112.338 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -63.58 -37.44 87.32 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.81 0.844 . . . . 0.0 112.491 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.39 91.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.962 0.801 . . . . 0.0 111.249 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.83 -46.5 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 119.018 -0.515 . . . . 0.0 110.228 177.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -71.15 -27.17 63.35 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.994 0.815 . . . . 0.0 112.719 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.67 -46.17 73.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 112.152 171.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -79.49 -30.8 42.15 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -134.4 77.79 58.91 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 126.173 1.789 . . . . 0.0 110.377 -172.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.42 -8.78 24.52 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.643 2.895 . . . . 0.0 114.997 -168.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -81.58 -9.5 59.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.54 -45.68 24.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.177 0.899 . . . . 0.0 111.848 177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 117.216 2.302 . . . . 0.0 117.216 177.558 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 110.78 -0.082 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -146.17 146.83 30.98 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.411 1.485 . . . . 0.0 111.382 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.3 14.71 80.55 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.3 0.952 . . . . 0.0 115.054 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.5 p -103.61 178.99 4.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.894 2.078 . . . . 0.0 113.134 -175.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.3 m80 62.09 -166.14 0.22 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.355 1.862 . . . . 0.0 113.516 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.1 t60 57.08 54.88 6.48 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.618 1.567 . . . . 0.0 113.209 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -136.75 -174.06 3.61 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.204 1.802 . . . . 0.0 111.21 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.5 m80 58.75 30.96 20.69 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 126.181 1.793 . . . . 0.0 114.789 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -62.62 143.07 57.71 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.244 1.018 . . . . 0.0 112.57 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -146.88 156.09 42.82 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.875 1.27 . . . . 0.0 111.812 172.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -176.48 -173.49 42.14 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.699 1.142 . . . . 0.0 113.923 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.6 t 61.99 168.6 0.11 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.307 1.843 . . . . 0.0 114.54 -170.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 63.15 -156.64 41.14 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.574 1.083 . . . . 0.0 113.215 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.97 130.69 35.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.6 0.76 . . . . 0.0 111.538 172.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -83.13 175.98 9.56 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.546 1.138 . . . . 0.0 111.813 174.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.65 138.68 40.88 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -168.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.7 159.12 16.46 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.611 1.565 . . . . 0.0 114.068 172.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.02 149.83 50.68 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.411 1.485 . . . . 0.0 111.538 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -68.85 130.3 42.39 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.311 0.644 . . . . 0.0 109.828 162.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.05 -24.07 17.75 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.26 164.11 31.14 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.363 1.465 . . . . 0.0 112.275 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.98 -167.41 54.67 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 124.179 0.895 . . . . 0.0 114.637 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.44 -28.32 72.59 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 124.114 3.209 . . . . 0.0 114.685 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.0 mt -95.63 2.96 54.39 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.081 1.353 . . . . 0.0 113.536 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.61 127.28 15.34 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.946 0.793 . . . . 0.0 112.396 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.81 -4.65 75.75 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -176.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.5 mt -107.11 155.4 39.35 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 118.932 1.366 . . . . 0.0 112.487 -173.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -55.04 145.5 63.42 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.337 3.358 . . . . 0.0 112.814 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.9 t -81.62 -32.05 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.062 -0.399 . . . . 0.0 110.778 171.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -134.45 167.26 21.08 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.783 1.233 . . . . 0.0 113.487 -175.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.2 mtm180 -62.57 -34.8 77.7 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 121.639 -0.663 . . . . 0.0 111.942 173.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 t -66.16 -42.73 88.6 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.607 0.763 . . . . 0.0 111.243 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -60.2 -46.71 88.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.676 -0.64 . . . . 0.0 110.672 173.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.91 88.63 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.706 0.802 . . . . 0.0 112.394 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -61.95 -42.05 98.67 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.56 1.144 . . . . 0.0 112.041 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 62.0 t -72.81 -35.08 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.336 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.06 -43.99 97.07 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.542 1.519 . . . . 0.0 111.294 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.76 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.529 0.604 . . . . 0.0 110.741 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.22 -50.26 74.35 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.841 0.746 . . . . 0.0 112.195 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -64.0 -38.52 91.38 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.438 0.695 . . . . 0.0 112.265 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.22 -53.79 53.49 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.992 0.917 . . . . 0.0 110.951 173.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 67.9 t90 -54.08 -46.27 72.0 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.264 173.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.76 -45.62 88.99 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.293 0.951 . . . . 0.0 112.39 -173.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -64.09 -49.42 72.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.758 0.823 . . . . 0.0 111.763 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -61.09 -49.15 78.49 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.817 -0.552 . . . . 0.0 111.252 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -56.93 -41.29 77.95 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.111 1.364 . . . . 0.0 112.817 175.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -64.01 -33.67 76.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.605 1.093 . . . . 0.0 112.777 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -77.6 -37.41 50.41 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 172.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -150.11 107.42 3.2 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 128.003 2.521 . . . . 0.0 109.952 -172.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.04 -12.33 23.62 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.338 3.359 . . . . 0.0 117.13 -157.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 21.7 p-90 -69.75 -19.79 63.52 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -172.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 36.1 tp -67.27 138.79 57.13 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -159.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -83.83 148.78 26.8 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.54 1.536 . . . . 0.0 111.72 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 tt -114.91 119.56 36.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.767 1.627 . . . . 0.0 109.15 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -139.12 114.5 9.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.468 1.107 . . . . 0.0 111.487 174.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.66 49.58 1.14 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.0 m -73.62 161.01 30.78 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.736 0.814 . . . . 0.0 110.993 160.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -51.84 -38.25 55.13 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.953 0.901 . . . . 0.0 113.175 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -60.0 -40.85 90.62 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.24 -38.17 89.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.74 -47.02 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.403 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -69.46 -31.79 70.31 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.947 0.794 . . . . 0.0 112.562 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -70.39 -37.2 74.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.841 0.857 . . . . 0.0 113.257 174.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -73.14 -41.22 64.2 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.03 0.832 . . . . 0.0 112.85 171.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.9 82.42 64.23 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.728 1.611 . . . . 0.0 110.156 -165.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -70.07 -10.11 27.56 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.484 2.789 . . . . 0.0 114.589 -167.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -78.52 -10.31 59.67 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.5 -31.64 32.77 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.508 1.049 . . . . 0.0 113.316 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 119.577 1.081 . . . . 0.0 112.728 171.975 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.4 ttp . . . . . 0 N--CA 1.496 1.84 0 N-CA-C 110.864 -0.051 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -126.05 155.15 41.97 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.664 1.586 . . . . 0.0 111.524 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -167.07 6.81 0.05 OUTLIER Glycine 0 CA--C 1.538 1.484 0 N-CA-C 116.779 1.471 . . . . 0.0 116.779 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -89.85 137.02 32.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.158 1.479 . . . . 0.0 112.453 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -145.6 144.68 30.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.573 1.549 . . . . 0.0 111.768 -178.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.0 p-80 -154.72 144.21 21.36 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.137 1.375 . . . . 0.0 111.711 173.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -158.33 146.98 18.87 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.801 1.24 . . . . 0.0 111.327 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -154.31 148.47 25.86 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.964 1.306 . . . . 0.0 111.317 175.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -151.9 164.03 37.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 0.0 113.547 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -131.11 161.89 31.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.977 1.711 . . . . 0.0 112.035 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 85.74 142.19 6.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 124.856 1.217 . . . . 0.0 112.702 -169.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -127.0 4.58 6.5 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -160.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 62.04 28.76 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.988 1.155 . . . . 0.0 115.988 170.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.14 49.5 0.96 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.668 1.587 . . . . 0.0 114.969 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 pp -81.58 -10.34 59.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.6 145.33 56.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.484 1.113 . . . . 0.0 113.438 -177.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.16 151.07 26.95 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.94 149.16 44.62 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.622 1.569 . . . . 0.0 111.964 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -69.08 141.5 54.73 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.85 0.86 . . . . 0.0 110.438 162.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.51 -15.96 14.85 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -172.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.87 159.1 42.94 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.726 1.211 . . . . 0.0 113.158 -170.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.09 -163.57 52.4 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 124.364 0.983 . . . . 0.0 114.44 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.06 -24.35 73.15 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.545 2.83 . . . . 0.0 113.99 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.1 -6.82 59.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.706 1.603 . . . . 0.0 113.625 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.44 16.76 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.68 1.127 . . . . 0.0 111.967 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.36 -0.93 78.75 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 116.102 1.201 . . . . 0.0 116.102 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.59 153.21 41.52 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 119.127 1.464 . . . . 0.0 112.082 -174.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -55.09 143.49 73.74 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.435 3.423 . . . . 0.0 113.492 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.5 t -78.01 -37.8 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.983 -0.448 . . . . 0.0 111.358 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.9 t -139.06 166.1 25.39 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.367 1.467 . . . . 0.0 112.671 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -57.68 -29.44 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.094 -1.004 . . . . 0.0 112.896 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -62.38 -43.07 99.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.572 0.749 . . . . 0.0 111.941 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -64.68 -43.15 94.45 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.565 -0.71 . . . . 0.0 110.259 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.45 -46.83 88.43 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -57.12 -46.9 82.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.02 1.328 . . . . 0.0 111.417 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.4 t -72.69 -32.45 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 118.862 -0.59 . . . . 0.0 112.439 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.7 mt -65.33 -42.38 93.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.179 1.354 . . . . 0.0 111.291 171.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -40.36 88.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 118.732 0.696 . . . . 0.0 110.762 173.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -60.74 -52.04 66.79 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.776 0.716 . . . . 0.0 112.158 174.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -61.78 -39.96 93.51 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.532 0.605 . . . . 0.0 111.807 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -59.38 -54.51 45.89 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.915 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -51.62 -46.32 63.58 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.386 0.994 . . . . 0.0 111.458 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.37 -45.36 84.41 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.879 0.763 . . . . 0.0 111.953 -172.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -70.4 -42.52 71.55 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.37 -0.831 . . . . 0.0 111.927 178.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -58.48 -48.89 79.29 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 121.61 -0.681 . . . . 0.0 110.683 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -63.51 -40.01 95.92 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.516 1.527 . . . . 0.0 112.46 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -65.86 -29.91 70.44 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.865 0.757 . . . . 0.0 112.444 172.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.7 t -79.21 -37.53 37.94 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 171.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -149.04 105.67 3.38 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 127.892 2.477 . . . . 0.0 110.021 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.98 -11.63 25.58 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.648 3.566 . . . . 0.0 117.17 -157.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -69.1 -23.34 64.0 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -173.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 141.78 57.17 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -161.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -98.29 148.12 23.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.052 1.341 . . . . 0.0 111.983 172.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 tt -98.63 118.94 36.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.683 1.593 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -134.54 115.81 14.33 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 111.279 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.99 51.4 0.91 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.439 1.095 . . . . 0.0 113.406 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.4 t -63.89 155.54 30.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.709 160.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -56.98 -29.96 63.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.813 -1.179 . . . . 0.0 112.335 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -60.22 -41.85 93.97 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.424 -0.798 . . . . 0.0 112.53 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.29 86.98 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.679 0.792 . . . . 0.0 111.939 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.46 -48.1 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.514 175.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.88 -33.14 74.95 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.048 0.84 . . . . 0.0 112.288 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -69.3 -39.79 78.07 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.287 1.035 . . . . 0.0 113.002 174.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.0 -37.38 61.84 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -133.07 85.57 45.14 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 110.281 -168.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.84 -16.09 41.13 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.161 2.574 . . . . 0.0 114.619 -166.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 -75.2 -11.68 60.13 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 175.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.91 -26.93 49.36 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.095 0.861 . . . . 0.0 112.31 175.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 . . . . . 0 C--O 1.254 1.328 0 C-N-CA 128.272 2.629 . . . . 0.0 116.757 161.759 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 120.344 0.116 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.0 ptp85 -69.26 164.1 23.51 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.501 1.121 . . . . 0.0 113.415 178.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -161.84 -174.15 31.38 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.925 1.25 . . . . 0.0 113.78 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.8 t -151.96 -58.87 0.15 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.053 1.341 . . . . 0.0 110.748 177.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m80 55.29 29.33 12.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.842 1.657 . . . . 0.0 115.431 166.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -71.68 148.23 46.66 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.986 0.914 . . . . 0.0 112.603 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -147.51 142.39 26.87 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.874 1.67 . . . . 0.0 110.408 172.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -138.02 131.55 30.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.402 1.081 . . . . 0.0 111.902 -175.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -153.97 150.16 28.01 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.811 1.644 . . . . 0.0 110.346 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -152.38 150.85 30.13 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.517 1.127 . . . . 0.0 112.994 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.95 117.51 0.48 Allowed Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.672 1.606 . . . . 0.0 111.012 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -155.58 140.06 16.83 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.177 0.991 . . . . 0.0 112.356 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 74.28 162.38 8.66 Favored Glycine 0 CA--C 1.54 1.64 0 C-N-CA 125.466 1.507 . . . . 0.0 115.694 176.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.96 147.37 22.67 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.357 1.863 . . . . 0.0 110.84 171.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 pp -93.33 -12.97 28.74 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.47 149.36 44.25 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.437 1.095 . . . . 0.0 113.357 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.78 148.26 26.81 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.9 mt -123.75 151.08 43.64 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.86 1.664 . . . . 0.0 111.825 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -69.56 131.68 45.05 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.512 0.725 . . . . 0.0 109.88 161.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.43 -22.55 17.63 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -140.24 162.92 34.12 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.132 1.373 . . . . 0.0 112.647 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.14 -164.45 54.92 Favored Glycine 0 CA--C 1.542 1.771 0 C-N-CA 124.169 0.89 . . . . 0.0 114.463 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.67 -28.94 68.54 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 123.915 3.076 . . . . 0.0 114.646 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 79.9 mt -94.09 1.75 56.11 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.893 1.277 . . . . 0.0 113.542 -176.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.88 125.59 12.23 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.196 0.907 . . . . 0.0 112.268 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.95 -3.39 73.58 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 116.165 1.226 . . . . 0.0 116.165 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.2 mt -107.55 154.9 40.5 Favored Pre-proline 0 CA--C 1.551 1.006 0 CA-C-N 118.977 1.389 . . . . 0.0 112.566 -173.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -56.0 145.26 75.4 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.178 3.252 . . . . 0.0 113.008 176.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -79.18 -28.97 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.252 -0.28 . . . . 0.0 111.398 172.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.5 p -140.94 165.37 27.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.863 1.265 . . . . 0.0 112.262 -174.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -65.02 -27.08 68.56 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.172 -0.955 . . . . 0.0 112.694 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.3 t -69.07 -43.69 74.08 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.339 0.655 . . . . 0.0 111.444 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -61.96 -41.95 98.57 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.247 -0.908 . . . . 0.0 110.908 172.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.64 85.18 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.574 0.749 . . . . 0.0 112.693 176.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.5 -44.91 85.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.99 1.716 . . . . 0.0 111.757 174.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.26 -35.23 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.218 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.69 -45.27 93.56 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.605 1.548 . . . . 0.0 111.314 173.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.2 mt -62.52 -43.45 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 118.272 0.487 . . . . 0.0 110.471 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -59.73 -50.64 73.03 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.878 -0.514 . . . . 0.0 112.342 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -32.69 68.65 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.509 -0.744 . . . . 0.0 111.763 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.45 -48.88 73.63 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.611 0.765 . . . . 0.0 110.918 171.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.2 t90 -55.2 -44.69 75.57 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.788 170.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -65.8 -45.68 81.48 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 120.05 1.296 . . . . 0.0 112.093 -175.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.79 -46.57 88.99 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.945 -0.472 . . . . 0.0 111.695 174.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -58.05 -51.34 70.09 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.069 0.547 . . . . 0.0 111.156 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -53.7 -40.35 65.94 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.526 1.531 . . . . 0.0 111.968 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -68.53 -39.15 81.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.0 m -75.9 -29.36 58.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 175.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -154.2 105.02 2.42 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 128.732 2.813 . . . . 0.0 109.01 -162.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.67 -15.21 24.4 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.452 2.768 . . . . 0.0 116.164 -161.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -71.7 -25.29 62.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.7 tp -69.46 145.89 52.39 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -157.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -107.63 151.69 25.3 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.29 1.836 . . . . 0.0 111.994 172.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -105.11 119.49 39.17 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.678 1.591 . . . . 0.0 109.879 -176.297 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.79 120.47 18.35 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.609 1.163 . . . . 0.0 111.625 176.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.421 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.92 57.16 0.73 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.732 1.213 . . . . 0.0 112.639 -176.151 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 94.1 p -65.09 160.56 20.81 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.532 163.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -52.45 -39.21 60.8 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.203 -0.936 . . . . 0.0 111.279 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.1 -43.81 98.32 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.313 1.045 . . . . 0.0 112.546 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.76 85.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.665 1.121 . . . . 0.0 112.072 174.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.91 -47.12 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.117 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -68.04 -31.15 70.62 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.704 0.684 . . . . 0.0 112.639 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -71.22 -40.57 71.01 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.632 1.173 . . . . 0.0 112.964 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -73.42 -37.89 65.76 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.843 0.747 . . . . 0.0 112.937 174.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -130.72 85.34 55.99 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.853 1.661 . . . . 0.0 110.076 -168.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -70.41 -8.95 24.82 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.448 2.765 . . . . 0.0 114.852 -168.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -81.24 -9.31 59.8 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.67 -35.09 30.31 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.3 0.954 . . . . 0.0 113.223 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.315 0 CA-C-O 117.426 -1.273 . . . . 0.0 112.645 173.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 mpp? . . . . . 0 N--CA 1.501 2.081 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 48.92 53.67 12.11 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.464 1.506 . . . . 0.0 113.038 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.11 -160.82 10.25 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.748 1.166 . . . . 0.0 114.249 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 t 65.45 152.25 0.06 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.105 2.162 . . . . 0.0 114.856 -169.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -155.77 131.53 9.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.859 1.664 . . . . 0.0 110.83 -174.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -155.51 138.69 15.61 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.329 1.051 . . . . 0.0 112.286 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -142.55 145.89 34.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.199 1.8 . . . . 0.0 111.102 174.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -149.78 161.91 41.3 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.528 1.131 . . . . 0.0 111.99 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 62.52 148.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 128.611 2.764 . . . . 0.0 115.648 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -150.14 26.29 0.79 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.879 1.272 . . . . 0.0 113.51 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.95 -30.11 69.25 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 124.597 1.094 . . . . 0.0 115.37 -174.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 t 42.49 56.08 3.9 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.54 1.936 . . . . 0.0 114.626 167.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -65.61 106.72 1.64 Allowed Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.295 -0.878 . . . . 0.0 114.096 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -103.06 3.9 36.58 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 pp -75.17 -11.08 60.0 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 -170.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.43 142.01 58.32 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.063 0.945 . . . . 0.0 113.359 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.73 154.06 22.04 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.0 mt -125.77 148.81 48.98 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.442 1.497 . . . . 0.0 112.318 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -70.61 142.06 51.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.316 1.047 . . . . 0.0 110.503 163.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.91 -15.99 14.77 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -172.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.0 159.27 42.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.565 1.146 . . . . 0.0 113.07 -170.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.1 -162.91 52.75 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.385 0.993 . . . . 0.0 114.322 177.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.59 -24.18 74.15 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.46 2.773 . . . . 0.0 113.799 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.16 -6.22 59.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.655 1.582 . . . . 0.0 113.699 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.99 125.67 17.97 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.822 1.192 . . . . 0.0 111.99 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.68 -0.56 80.18 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 115.965 1.146 . . . . 0.0 115.965 -177.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.2 mt -106.78 153.38 40.79 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.1 1.45 . . . . 0.0 112.476 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -56.09 142.46 86.07 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.423 3.416 . . . . 0.0 113.07 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 t -77.82 -33.29 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.461 0.305 . . . . 0.0 110.937 173.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.18 164.72 26.72 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.787 1.235 . . . . 0.0 112.709 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.58 -29.19 70.48 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.119 -0.988 . . . . 0.0 112.53 173.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.8 m -68.36 -41.03 81.27 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.704 0.802 . . . . 0.0 111.292 173.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -61.68 -45.64 93.12 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.792 0.723 . . . . 0.0 110.588 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.41 86.28 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.262 0.625 . . . . 0.0 112.488 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -59.92 -42.18 93.37 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.425 1.49 . . . . 0.0 112.089 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.2 t -75.72 -33.12 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.385 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.63 -42.64 99.71 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.737 1.608 . . . . 0.0 111.331 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.5 mt -63.21 -42.78 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 122.991 0.517 . . . . 0.0 110.667 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -59.11 -47.03 86.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.659 0.663 . . . . 0.0 112.425 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -68.39 -37.46 80.39 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 111.998 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -63.17 -50.38 70.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.729 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -53.93 -43.61 69.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.765 1.166 . . . . 0.0 112.468 173.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -56.18 -50.62 70.67 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.971 1.26 . . . . 0.0 111.765 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.59 -48.03 73.7 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 178.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -56.07 -51.35 68.14 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.455 1.102 . . . . 0.0 110.632 176.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 91' ' ' LYS . 1.0 OUTLIER -56.41 -44.25 80.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.463 1.505 . . . . 0.0 111.883 176.23 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -61.91 -33.88 75.04 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.396 0.998 . . . . 0.0 112.848 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.9 m -78.68 -38.14 40.08 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -152.21 102.97 2.78 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 127.749 2.42 . . . . 0.0 109.659 -169.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.24 -14.08 25.66 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.966 3.111 . . . . 0.0 116.576 -160.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -65.83 -24.18 66.84 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.4 tp -64.62 145.03 56.77 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.78 0.718 . . . . 0.0 112.614 -165.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -102.34 150.28 23.49 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.955 1.302 . . . . 0.0 112.406 172.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.423 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.4 OUTLIER -102.38 115.94 31.6 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 109.497 -176.781 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.59 118.48 16.25 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.467 1.107 . . . . 0.0 111.842 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.423 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -156.12 54.41 0.57 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.592 1.157 . . . . 0.0 113.429 -173.054 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 t -75.07 163.35 27.67 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.594 0.758 . . . . 0.0 111.109 163.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -50.37 -39.45 46.63 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.688 1.195 . . . . 0.0 112.714 -177.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.55 -40.03 93.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.846 0.859 . . . . 0.0 112.719 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.99 88.5 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.517 0.727 . . . . 0.0 111.558 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.01 -46.64 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.346 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -68.0 -33.18 74.13 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.447 0.567 . . . . 0.0 112.342 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.9 ttt-85 -68.37 -41.17 80.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.594 0.758 . . . . 0.0 112.393 174.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.6 mtt-85 -73.44 -37.7 65.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.859 0.864 . . . . 0.0 112.785 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -134.55 88.0 30.33 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.976 1.71 . . . . 0.0 110.33 -170.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.22 -14.54 37.98 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.177 2.585 . . . . 0.0 114.672 -167.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -78.48 -6.87 56.6 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 177.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -86.1 -30.13 22.8 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 . . . . . 0 C--O 1.255 1.39 0 CA-C-N 119.342 0.974 . . . . 0.0 113.098 178.369 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttm . . . . . 0 N--CA 1.497 1.921 0 CA-C-O 119.604 -0.236 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -84.38 -34.48 23.58 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.661 0.784 . . . . 0.0 112.936 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.76 162.35 14.52 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.839 1.209 . . . . 0.0 113.619 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 t -157.09 175.76 13.65 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.375 1.07 . . . . 0.0 112.498 -177.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.6 m80 57.97 110.78 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.938 2.895 . . . . 0.0 115.156 177.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -137.54 146.92 44.71 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.901 1.281 . . . . 0.0 111.838 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -155.34 -173.46 4.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.899 1.68 . . . . 0.0 111.394 -175.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.2 p-80 -140.73 145.3 36.26 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.245 1.018 . . . . 0.0 113.029 172.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -142.86 173.12 11.83 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.817 2.047 . . . . 0.0 111.247 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 64.26 -178.88 0.17 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.367 1.867 . . . . 0.0 114.706 173.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -173.58 -179.52 44.29 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.133 0.873 . . . . 0.0 114.285 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.0 p -67.02 152.6 45.49 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.68 1.192 . . . . 0.0 113.114 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.33 -11.23 31.8 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.782 1.182 . . . . 0.0 115.429 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -132.39 18.54 4.39 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.118 1.767 . . . . 0.0 113.174 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.406 HD23 ' H ' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -77.81 165.04 24.66 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.186 1.395 . . . . 0.0 112.028 -177.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.406 ' H ' HD23 ' A' ' 60' ' ' LEU . . . -56.85 145.43 29.67 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -171.3 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.23 154.33 31.35 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.663 1.585 . . . . 0.0 113.88 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -121.81 149.58 43.13 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.457 1.503 . . . . 0.0 111.851 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -68.33 141.14 55.89 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.911 0.884 . . . . 0.0 110.487 162.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.14 -16.69 15.17 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.14 159.85 41.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.616 1.166 . . . . 0.0 112.862 -170.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.77 -164.39 53.23 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 124.248 0.928 . . . . 0.0 114.419 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.71 -24.05 74.09 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.489 2.793 . . . . 0.0 113.943 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.37 -6.14 59.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.749 1.62 . . . . 0.0 113.691 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.66 126.04 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.825 1.193 . . . . 0.0 112.037 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.22 -1.61 80.1 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 115.987 1.155 . . . . 0.0 115.987 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.8 mt -107.28 153.32 41.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 119.063 1.431 . . . . 0.0 112.238 -174.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -56.97 144.31 89.73 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 124.315 3.343 . . . . 0.0 113.043 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.7 t -78.61 -36.12 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.596 0.358 . . . . 0.0 111.493 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.5 t -140.98 166.12 25.66 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.402 1.481 . . . . 0.0 112.838 176.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -57.21 -28.96 63.32 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.409 1.484 . . . . 0.0 113.365 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.4 t -63.99 -42.07 97.32 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.371 0.668 . . . . 0.0 111.94 171.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -65.46 -45.04 85.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.173 -0.954 . . . . 0.0 110.326 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.9 89.15 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.639 0.654 . . . . 0.0 112.396 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -60.29 -47.7 84.89 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 0.0 111.676 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 74.1 t -69.35 -34.27 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.388 -0.82 . . . . 0.0 112.277 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.6 -43.65 93.11 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.505 1.502 . . . . 0.0 111.701 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.5 mt -68.0 -37.4 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 118.622 0.646 . . . . 0.0 110.893 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.93 -49.64 76.89 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.772 0.714 . . . . 0.0 111.993 171.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.78 -39.78 90.11 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.787 0.835 . . . . 0.0 111.788 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.49 -57.73 11.49 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.853 -1.07 . . . . 0.0 111.319 171.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 60.1 t90 -52.6 -46.75 67.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.127 1.33 . . . . 0.0 112.038 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -65.37 -43.32 91.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.035 0.934 . . . . 0.0 112.302 -174.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.43 -47.94 71.57 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.578 -0.701 . . . . 0.0 111.886 175.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -59.82 -44.79 93.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.57 0.748 . . . . 0.0 110.469 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.65 -35.75 80.63 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.983 1.313 . . . . 0.0 112.474 176.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -63.78 -39.08 93.4 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.341 0.973 . . . . 0.0 112.808 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -75.58 -36.27 60.39 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 175.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -149.92 103.4 3.2 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 127.637 2.375 . . . . 0.0 109.488 -170.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 -12.52 27.02 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.187 3.258 . . . . 0.0 116.632 -159.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.9 p-90 -68.93 -23.03 64.12 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.16 132.44 50.41 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -160.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -85.01 133.02 34.26 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.192 1.397 . . . . 0.0 110.601 170.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.8 tt -79.44 118.12 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.961 0.904 . . . . 0.0 108.72 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -122.07 115.38 22.38 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.49 0.716 . . . . 0.0 111.364 171.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.9 142.3 18.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.448 1.118 . . . . 0.0 112.968 164.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -152.1 171.62 17.6 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.766 2.827 . . . . 0.0 107.169 166.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -53.98 -34.1 58.86 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.612 -1.305 . . . . 0.0 112.96 -176.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.705 0.802 . . . . 0.0 112.848 171.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.5 87.74 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.851 0.861 . . . . 0.0 111.902 174.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.67 -44.93 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.132 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -67.92 -34.81 77.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.316 0.507 . . . . 0.0 112.069 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -65.18 -43.79 90.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.15 0.98 . . . . 0.0 112.176 175.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -74.79 -40.91 60.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.392 0.677 . . . . 0.0 112.328 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -125.99 90.28 50.6 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.859 1.664 . . . . 0.0 110.39 -172.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.04 -15.87 40.14 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.07 2.513 . . . . 0.0 114.696 -166.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -79.91 -6.89 58.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.51 -28.78 26.48 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--O 1.254 1.299 0 CA-C-N 119.202 0.91 . . . . 0.0 112.86 177.603 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.9 mtm . . . . . 0 N--CA 1.499 1.977 0 CA-C-O 120.221 0.058 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 155.55 35.58 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.978 0.911 . . . . 0.0 112.735 176.188 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.55 -169.42 37.37 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.102 0.858 . . . . 0.0 113.692 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 m -101.52 -43.27 5.95 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.378 1.071 . . . . 0.0 112.669 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -149.65 23.95 0.88 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.103 1.361 . . . . 0.0 112.182 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -101.09 -8.16 22.55 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 -157.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -130.65 141.37 50.42 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.977 1.311 . . . . 0.0 112.178 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -156.64 167.46 30.38 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.91 1.684 . . . . 0.0 111.879 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.5 p80 -146.1 151.63 38.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.151 1.381 . . . . 0.0 112.028 174.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -158.36 179.76 8.85 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.119 1.367 . . . . 0.0 112.295 -177.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 87.91 163.43 39.12 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 125.586 1.565 . . . . 0.0 116.0 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -154.04 150.62 28.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.981 1.712 . . . . 0.0 111.762 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -122.96 14.26 8.45 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 125.936 1.731 . . . . 0.0 114.715 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.25 -5.32 26.84 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 116.053 1.872 . . . . 0.0 116.053 -165.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.5 tp -69.64 -31.05 68.92 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.883 1.273 . . . . 0.0 112.454 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -87.36 147.95 25.24 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.706 0.802 . . . . 0.0 112.991 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.53 24.97 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 176.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.67 149.97 50.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.627 1.571 . . . . 0.0 111.815 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.77 129.62 40.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.908 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.44 -17.56 22.37 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -173.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.01 167.22 27.35 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.944 1.298 . . . . 0.0 112.942 -173.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.84 -165.95 54.74 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 124.032 0.825 . . . . 0.0 114.417 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -56.06 -28.41 69.47 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.982 3.121 . . . . 0.0 114.631 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.39 3.22 54.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 0.0 113.458 -176.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.3 125.83 11.76 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.141 0.882 . . . . 0.0 112.37 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.22 -3.27 76.1 Favored Glycine 0 CA--C 1.53 0.983 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -177.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 36.4 mt -106.14 155.27 38.8 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 119.01 1.405 . . . . 0.0 112.452 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -54.53 143.83 65.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.313 3.342 . . . . 0.0 112.585 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.8 t -78.15 -32.29 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 122.121 -0.362 . . . . 0.0 110.785 170.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -135.52 165.12 26.25 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.503 1.121 . . . . 0.0 113.422 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -58.75 -32.01 68.86 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.581 0.752 . . . . 0.0 112.821 171.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.5 m -71.17 -40.66 71.13 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.935 0.894 . . . . 0.0 111.704 174.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -62.07 -43.87 97.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.787 0.721 . . . . 0.0 110.561 172.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.83 -48.27 82.34 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.402 0.681 . . . . 0.0 111.991 177.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.4 ttm-85 -56.58 -46.07 80.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.856 1.262 . . . . 0.0 111.935 175.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 69.1 t -73.47 -34.15 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.08 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.85 -44.84 88.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 120.524 1.511 . . . . 0.0 111.427 173.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -62.18 -42.69 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.175 0.59 . . . . 0.0 110.338 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -60.93 -52.14 66.3 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -63.21 -39.6 95.09 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.332 0.653 . . . . 0.0 111.696 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.89 -52.84 63.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.144 0.578 . . . . 0.0 111.004 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -55.16 -41.53 71.96 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.18 0.9 . . . . 0.0 112.864 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -65.43 -45.03 85.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.687 1.131 . . . . 0.0 111.878 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -65.99 -43.9 86.42 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.304 -0.872 . . . . 0.0 112.336 175.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.98 -48.29 82.11 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.058 0.543 . . . . 0.0 110.491 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -59.14 -33.55 71.02 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.519 1.128 . . . . 0.0 112.166 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.67 -44.67 93.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.919 0.888 . . . . 0.0 112.985 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.1 p -86.02 -28.38 24.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -151.48 103.14 2.91 Favored Pre-proline 0 CA--C 1.557 1.226 0 C-N-CA 128.693 2.797 . . . . 0.0 109.832 -176.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.84 -13.74 24.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.94 3.093 . . . . 0.0 116.767 -160.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -67.28 -24.1 65.74 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -171.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.78 144.85 56.72 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -161.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -96.69 149.89 21.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.251 1.42 . . . . 0.0 113.167 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.19 118.4 36.44 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.785 1.634 . . . . 0.0 109.213 -178.127 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -131.53 110.61 11.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.235 1.014 . . . . 0.0 112.07 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.08 55.2 0.99 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.193 1.397 . . . . 0.0 112.674 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 92.5 p -62.14 154.96 25.65 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.169 156.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.05 -32.09 70.59 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.48 -1.387 . . . . 0.0 111.284 178.495 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -57.33 -43.73 83.61 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.578 1.151 . . . . 0.0 112.457 167.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.77 76.84 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.32 0.648 . . . . 0.0 112.652 174.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.28 -48.77 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 174.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.32 -29.53 69.12 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.437 0.562 . . . . 0.0 112.258 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -70.3 -45.19 66.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.602 1.161 . . . . 0.0 112.536 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -69.85 -37.41 76.14 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 118.658 0.663 . . . . 0.0 112.749 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -130.77 84.62 58.04 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.862 1.665 . . . . 0.0 110.475 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.25 -12.86 34.85 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.307 2.671 . . . . 0.0 114.571 -168.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -76.49 -11.56 59.9 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.21 -26.66 35.74 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 119.177 0.898 . . . . 0.0 112.818 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 128.03 2.532 . . . . 0.0 116.488 167.316 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mtp . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 119.233 -0.413 . . . . 0.0 111.33 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -73.2 149.66 42.7 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.367 1.067 . . . . 0.0 111.696 177.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -163.06 175.08 39.43 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.935 1.255 . . . . 0.0 113.277 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 t -86.24 156.88 20.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.538 1.135 . . . . 0.0 112.604 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -137.35 155.62 49.19 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.961 1.705 . . . . 0.0 111.792 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.6 p-80 -139.66 149.49 43.79 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.028 1.331 . . . . 0.0 112.144 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.404 ' CG ' ' H ' ' A' ' 8' ' ' HIS . 1.9 t60 -154.8 -168.41 2.89 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.901 1.68 . . . . 0.0 110.501 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . 0.404 ' H ' ' CG ' ' A' ' 7' ' ' HIS . 86.7 m-70 57.13 75.11 0.38 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.829 2.052 . . . . 0.0 114.164 169.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.5 m80 -77.83 40.36 0.31 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.42 1.488 . . . . 0.0 113.031 177.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.91 163.45 12.2 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.529 1.932 . . . . 0.0 113.183 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -174.4 172.62 45.53 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.515 1.055 . . . . 0.0 113.638 175.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.5 p -146.31 158.61 43.9 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -175.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -79.44 173.0 55.2 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.316 0.96 . . . . 0.0 113.553 172.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.66 53.76 1.39 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.375 1.47 . . . . 0.0 113.04 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.5 mt -75.12 -24.78 58.08 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.225 1.01 . . . . 0.0 113.485 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.58 145.67 54.65 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.72 153.92 32.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.419 1.488 . . . . 0.0 114.122 171.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.42 149.88 43.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.633 1.573 . . . . 0.0 111.796 -178.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -69.05 141.43 54.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.897 0.879 . . . . 0.0 110.265 163.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.77 -17.71 15.46 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.33 160.22 40.33 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.645 1.178 . . . . 0.0 113.074 -170.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.04 -164.11 53.76 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 124.484 1.04 . . . . 0.0 114.45 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.79 -24.11 74.58 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.61 2.873 . . . . 0.0 113.812 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -6.17 59.35 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.759 1.624 . . . . 0.0 113.607 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.41 126.22 18.61 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.718 1.145 . . . . 0.0 112.23 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 -1.11 81.26 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -108.12 152.78 41.96 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-N 119.045 1.423 . . . . 0.0 112.363 -173.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.24 144.2 91.47 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 124.387 3.391 . . . . 0.0 113.23 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.8 t -80.48 -37.39 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 122.871 0.468 . . . . 0.0 111.537 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -139.05 168.92 18.76 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.356 1.462 . . . . 0.0 113.172 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -58.21 -35.06 71.09 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.753 1.221 . . . . 0.0 111.446 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -61.0 -39.95 91.66 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.264 1.026 . . . . 0.0 112.503 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -67.11 -47.01 72.42 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.534 -0.729 . . . . 0.0 110.005 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.19 -42.4 90.8 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.734 0.697 . . . . 0.0 112.524 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -58.96 -49.03 79.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.059 1.743 . . . . 0.0 111.703 172.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.11 -35.44 63.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-O 118.632 -0.699 . . . . 0.0 112.346 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.0 -48.64 79.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.069 1.304 . . . . 0.0 110.947 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.4 mt -63.01 -41.05 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.757 0.708 . . . . 0.0 110.94 176.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -55.14 37.74 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 122.957 0.503 . . . . 0.0 110.974 176.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -65.29 -36.03 82.83 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.828 -1.17 . . . . 0.0 112.682 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -56.85 -55.61 32.24 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.211 1.004 . . . . 0.0 110.935 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 56.3 t90 -51.85 -43.36 63.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.756 169.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -64.52 -46.93 80.8 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.731 1.15 . . . . 0.0 112.211 -173.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.03 -41.08 82.67 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.341 -0.849 . . . . 0.0 111.725 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.95 -50.46 73.98 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.581 -0.699 . . . . 0.0 111.098 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? -58.09 -39.9 79.76 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.607 1.963 . . . . 0.0 112.702 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -64.69 -35.79 82.17 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 118.899 0.772 . . . . 0.0 112.423 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.5 t -77.05 -37.57 54.41 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 174.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -150.52 106.98 3.11 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 128.127 2.571 . . . . 0.0 109.796 -172.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.55 -12.59 22.53 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.463 3.442 . . . . 0.0 116.919 -159.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -66.05 -25.02 66.85 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -174.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.1 tp -66.5 142.85 57.4 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -164.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -104.19 143.58 32.75 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.041 1.336 . . . . 0.0 111.949 175.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.42 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -93.64 119.84 33.15 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.226 1.41 . . . . 0.0 109.78 -178.561 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -135.1 120.62 19.27 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.551 1.141 . . . . 0.0 111.609 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.42 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.01 52.17 0.8 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.72 1.208 . . . . 0.0 112.876 -176.153 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.7 m -68.02 161.29 27.01 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.267 164.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -52.15 -38.52 57.84 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.991 -1.068 . . . . 0.0 113.075 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.73 -39.07 90.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.068 0.947 . . . . 0.0 112.787 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.1 -39.32 89.89 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.828 0.74 . . . . 0.0 111.485 174.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.26 -46.07 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.51 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.26 -30.09 67.05 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.479 0.581 . . . . 0.0 112.424 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -71.42 -40.24 70.56 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.748 0.819 . . . . 0.0 112.509 173.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 28.6 mmm-85 -68.93 -41.46 78.08 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.841 0.856 . . . . 0.0 112.127 173.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -136.38 90.57 17.48 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.576 1.55 . . . . 0.0 110.616 -168.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.13 -16.31 40.12 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.072 2.515 . . . . 0.0 114.795 -167.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -78.46 -6.51 55.54 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -85.95 -24.58 26.48 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 C--O 1.252 1.205 0 CA-C-N 119.76 1.164 . . . . 0.0 112.542 179.262 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ptt? . . . . . 0 N--CA 1.498 1.931 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -136.9 -48.91 0.62 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.773 1.229 . . . . 0.0 113.426 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.3 -172.0 43.02 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.883 1.23 . . . . 0.0 113.207 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.6 m -128.88 145.26 51.26 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.024 1.33 . . . . 0.0 112.112 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -140.57 162.6 34.99 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.706 1.603 . . . . 0.0 112.026 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -123.21 151.31 42.38 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.981 1.313 . . . . 0.0 111.987 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -134.31 17.79 3.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.162 1.385 . . . . 0.0 114.124 -168.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -83.7 120.08 25.56 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.415 -0.803 . . . . 0.0 112.64 -175.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -158.65 164.41 36.0 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.573 1.949 . . . . 0.0 110.806 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -117.03 -65.9 1.14 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.244 1.018 . . . . 0.0 111.121 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.71 -170.26 32.54 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.47 1.033 . . . . 0.0 115.525 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.4 m 56.19 23.41 7.0 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.422 1.889 . . . . 0.0 115.694 174.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -86.25 -1.08 86.52 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.834 1.094 . . . . 0.0 115.834 -174.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -147.11 169.88 18.35 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.003 1.321 . . . . 0.0 113.684 -172.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 pp -136.36 155.04 50.61 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.781 2.032 . . . . 0.0 113.778 -175.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.15 151.68 33.51 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.061 0.944 . . . . 0.0 113.015 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.72 156.19 29.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.568 1.547 . . . . 0.0 114.262 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -128.81 149.87 50.55 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.579 1.552 . . . . 0.0 112.069 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -69.82 132.32 45.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.978 0.911 . . . . 0.0 109.977 163.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.12 -24.34 16.9 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -175.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.11 163.85 31.86 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.072 1.349 . . . . 0.0 112.519 -171.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.18 -166.21 54.77 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.08 0.847 . . . . 0.0 114.494 176.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.99 -28.7 70.3 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.043 3.162 . . . . 0.0 114.634 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.2 mt -94.93 2.8 55.44 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.981 1.312 . . . . 0.0 113.478 -176.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.77 126.68 14.41 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.198 0.908 . . . . 0.0 112.328 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.89 -3.4 77.48 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.5 mt -107.59 155.17 40.16 Favored Pre-proline 0 CA--C 1.552 1.042 0 CA-C-N 119.068 1.434 . . . . 0.0 112.599 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -55.34 144.07 73.59 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 124.333 3.355 . . . . 0.0 112.945 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.89 -32.95 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 122.147 -0.346 . . . . 0.0 110.848 172.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.0 p -133.37 164.11 27.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.899 1.28 . . . . 0.0 112.75 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -65.79 -25.78 67.4 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.912 -1.117 . . . . 0.0 112.843 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.8 t -68.27 -44.05 76.41 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.351 0.66 . . . . 0.0 111.098 170.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -59.17 -43.96 92.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.69 0.677 . . . . 0.0 110.643 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.63 84.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.495 0.718 . . . . 0.0 112.638 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -58.44 -43.82 88.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.127 0.971 . . . . 0.0 111.903 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.1 t -73.86 -31.9 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.523 179.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.7 mt -65.75 -42.57 90.75 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.659 1.572 . . . . 0.0 111.472 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -63.22 -41.79 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 118.52 0.6 . . . . 0.0 110.505 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -60.11 -50.16 74.78 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.76 -0.587 . . . . 0.0 112.312 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.83 -36.76 83.09 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 118.77 0.714 . . . . 0.0 111.952 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -59.51 -54.07 50.85 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.702 169.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -52.07 -43.65 63.95 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 119.218 0.917 . . . . 0.0 111.886 173.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.17 -48.67 79.02 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.834 0.853 . . . . 0.0 111.592 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.13 -44.59 79.45 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.539 -0.726 . . . . 0.0 112.335 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -57.33 -50.0 74.34 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.394 0.678 . . . . 0.0 110.363 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.52 -41.22 89.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.849 1.66 . . . . 0.0 112.333 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.12 -33.08 74.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.612 0.765 . . . . 0.0 112.529 174.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.5 m -82.19 -35.41 28.35 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -151.14 102.81 2.98 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 127.746 2.418 . . . . 0.0 109.732 -168.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.57 -12.8 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.241 3.294 . . . . 0.0 116.781 -158.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.2 p-90 -66.33 -25.4 66.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -172.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.0 tp -67.65 145.54 54.72 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -161.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -101.75 149.47 24.13 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.458 1.503 . . . . 0.0 112.47 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.87 116.31 32.42 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.793 1.637 . . . . 0.0 109.191 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.51 117.63 15.44 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.637 1.175 . . . . 0.0 111.309 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.59 51.19 0.76 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -66.94 159.58 28.15 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.235 0.614 . . . . 0.0 111.289 163.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -50.35 -38.37 41.81 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.809 1.244 . . . . 0.0 112.335 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -62.36 -39.26 92.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.121 0.969 . . . . 0.0 113.018 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.22 85.86 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.525 0.73 . . . . 0.0 111.611 173.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.65 -48.02 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.211 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -67.01 -31.07 71.38 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.8 0.727 . . . . 0.0 112.212 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -68.65 -42.24 78.24 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.134 0.974 . . . . 0.0 112.787 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -71.72 -42.83 66.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -130.68 81.24 68.1 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.04 1.736 . . . . 0.0 109.96 -163.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.14 -14.37 40.54 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.198 2.599 . . . . 0.0 114.528 -167.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 34.8 p-80 -74.95 -10.36 59.41 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.21 -26.87 28.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.471 1.032 . . . . 0.0 113.734 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.23 0 CA-C-N 119.231 0.923 . . . . 0.0 111.587 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 tmm? . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -141.94 79.52 1.68 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.157 1.383 . . . . 0.0 111.063 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.99 159.14 52.61 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.351 0.976 . . . . 0.0 113.276 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -72.24 -37.48 69.13 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.425 0.69 . . . . 0.0 112.428 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -150.72 150.6 31.25 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.871 1.668 . . . . 0.0 111.246 173.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -148.21 142.55 26.26 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.595 1.158 . . . . 0.0 111.54 171.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -82.6 84.54 7.23 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.026 0.93 . . . . 0.0 110.046 170.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -74.15 -22.81 59.28 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -65.56 149.26 50.36 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.872 1.269 . . . . 0.0 112.247 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -152.87 136.03 15.67 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.315 1.046 . . . . 0.0 111.676 177.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 67.08 178.29 10.21 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 124.35 0.976 . . . . 0.0 114.224 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -160.93 158.08 27.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.873 1.269 . . . . 0.0 111.758 172.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 178.21 157.74 19.54 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.399 1.0 . . . . 0.0 113.787 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -88.77 33.71 0.77 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.73 1.612 . . . . 0.0 113.505 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 pp -76.01 -13.47 60.23 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -170.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.84 136.15 53.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.559 0.743 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.88 153.0 21.95 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -124.59 148.7 47.7 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.404 1.481 . . . . 0.0 112.021 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -69.88 141.6 53.14 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 110.327 162.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.62 -13.3 15.08 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -172.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.51 158.15 44.82 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.679 1.191 . . . . 0.0 112.893 -171.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.25 -163.0 51.45 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.431 1.015 . . . . 0.0 114.487 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.37 -24.09 73.04 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.522 2.814 . . . . 0.0 113.952 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.63 -7.13 59.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.647 1.579 . . . . 0.0 113.647 178.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.77 125.14 15.87 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.806 1.185 . . . . 0.0 112.027 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.2 -1.21 76.67 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 116.117 1.207 . . . . 0.0 116.117 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.0 mt -106.84 152.81 41.0 Favored Pre-proline 0 CA--C 1.549 0.938 0 CA-C-N 119.07 1.435 . . . . 0.0 112.452 -174.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -55.26 142.84 77.99 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 124.471 3.447 . . . . 0.0 112.866 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.3 t -78.02 -33.61 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.746 172.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.8 p -133.38 164.67 26.59 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.649 1.18 . . . . 0.0 113.185 -175.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -32.77 70.25 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.314 -0.866 . . . . 0.0 112.337 172.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -71.41 -38.7 71.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.929 0.892 . . . . 0.0 111.656 176.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -61.68 -45.22 94.92 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.826 0.739 . . . . 0.0 110.341 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.85 -46.84 89.0 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.223 0.609 . . . . 0.0 112.273 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -57.16 -44.8 83.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.145 1.378 . . . . 0.0 112.001 175.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.0 t -76.57 -32.34 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-O 118.563 -0.732 . . . . 0.0 112.29 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.8 mt -62.57 -44.16 97.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.417 1.462 . . . . 0.0 111.067 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.13 -40.8 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 118.658 0.663 . . . . 0.0 111.026 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -61.36 -48.64 80.36 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.68 -0.637 . . . . 0.0 112.314 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -65.17 -39.61 93.14 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.722 0.692 . . . . 0.0 111.909 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -55.87 -56.64 18.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.755 1.222 . . . . 0.0 110.667 173.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -51.44 -47.11 63.17 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 118.317 -0.849 . . . . 0.0 112.45 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.6 -47.82 79.88 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.879 1.218 . . . . 0.0 112.375 -173.216 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.0 -43.8 86.67 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.526 -0.734 . . . . 0.0 111.812 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -58.55 -52.96 63.42 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.844 -0.535 . . . . 0.0 110.998 175.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.3 tmtt? -54.73 -41.84 70.86 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.107 1.763 . . . . 0.0 112.613 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -67.6 -32.44 73.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.864 0.757 . . . . 0.0 112.806 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.3 t -78.07 -38.48 44.2 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 173.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -154.28 109.34 2.43 Favored Pre-proline 0 CA--C 1.554 1.108 0 C-N-CA 129.099 2.96 . . . . 0.0 109.482 -172.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.45 -13.72 22.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.182 3.255 . . . . 0.0 116.727 -160.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -67.43 -21.81 65.55 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.24 132.67 45.29 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.331 0.969 . . . . 0.0 110.81 -167.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -96.43 134.73 39.23 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.787 1.235 . . . . 0.0 112.413 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.411 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -83.16 119.14 24.15 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.88 1.272 . . . . 0.0 110.117 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -137.07 121.33 18.03 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.832 1.253 . . . . 0.0 111.579 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.411 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.2 55.55 0.76 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.638 1.175 . . . . 0.0 113.19 -177.886 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.9 t -63.82 153.27 37.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.464 158.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -54.9 -31.25 59.83 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.064 -1.022 . . . . 0.0 112.261 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.55 -41.5 94.64 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.871 0.869 . . . . 0.0 112.604 171.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.0 -37.64 88.34 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.776 0.83 . . . . 0.0 111.76 173.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -48.89 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.348 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -67.93 -30.46 69.78 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.688 0.677 . . . . 0.0 112.247 -178.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.56 -45.03 76.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.208 1.003 . . . . 0.0 112.379 172.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -71.81 -36.09 70.15 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.427 0.691 . . . . 0.0 112.771 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -133.02 84.74 47.89 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.919 1.688 . . . . 0.0 110.506 -169.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 -9.13 24.2 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.397 2.731 . . . . 0.0 114.979 -167.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 32.8 p-80 -81.44 -7.39 59.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.69 -36.97 28.1 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.273 0.942 . . . . 0.0 113.122 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.293 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.736 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 118.942 -0.551 . . . . 0.0 111.493 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -80.28 148.42 30.75 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.373 0.988 . . . . 0.0 111.378 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.43 -23.49 65.18 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.296 0.95 . . . . 0.0 114.899 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.7 m -83.44 42.93 0.86 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.55 1.54 . . . . 0.0 113.115 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -147.57 165.34 30.65 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.999 1.72 . . . . 0.0 111.984 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 57.99 28.05 15.68 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.13 1.772 . . . . 0.0 114.073 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -90.94 -8.92 47.95 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.627 1.971 . . . . 0.0 114.486 -175.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -112.31 135.33 53.13 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.394 1.478 . . . . 0.0 111.887 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -141.04 142.17 34.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 111.595 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -152.38 -173.12 4.44 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.066 1.347 . . . . 0.0 112.008 -178.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.27 157.13 15.84 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 123.943 0.783 . . . . 0.0 114.394 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.1 p -146.62 -29.5 0.38 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.99 156.9 12.88 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 124.643 1.116 . . . . 0.0 114.662 -179.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.98 44.45 1.13 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.548 . . . . 0.0 113.729 -171.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.2 pp -78.32 -14.06 59.58 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.3 51.89 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.018 0.927 . . . . 0.0 112.918 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -105.75 153.06 22.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.887 1.44 . . . . 0.0 114.887 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.9 mt -127.9 149.94 50.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.675 1.59 . . . . 0.0 111.977 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -70.19 131.04 43.63 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.602 0.761 . . . . 0.0 109.848 162.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.5 -25.18 17.71 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -175.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.36 164.55 29.95 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.307 1.443 . . . . 0.0 112.438 -171.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.29 -165.47 54.57 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.157 0.884 . . . . 0.0 114.542 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.33 -28.51 72.5 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 124.066 3.178 . . . . 0.0 114.648 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.0 mt -95.9 3.49 53.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.002 1.321 . . . . 0.0 113.519 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.37 126.03 12.3 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.098 0.863 . . . . 0.0 112.45 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.0 -2.96 76.58 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.79 1.186 . . . . 0.0 116.013 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.7 mt -107.49 154.66 40.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 CA-C-N 118.996 1.398 . . . . 0.0 112.657 -172.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -54.98 143.72 71.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.574 3.516 . . . . 0.0 112.925 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -79.05 -32.56 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.077 -0.389 . . . . 0.0 111.009 172.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -133.77 164.36 27.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.862 1.265 . . . . 0.0 112.491 -176.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.62 -26.58 68.46 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.914 -1.116 . . . . 0.0 112.808 172.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.2 t -68.19 -42.32 80.09 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.278 0.631 . . . . 0.0 111.169 171.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -61.25 -44.34 97.41 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.306 -0.871 . . . . 0.0 110.814 172.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.52 -47.16 87.39 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.371 0.668 . . . . 0.0 112.437 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.5 ttt-85 -58.09 -45.92 86.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.307 1.443 . . . . 0.0 111.833 175.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -74.2 -33.7 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.297 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.42 -46.34 88.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.235 1.38 . . . . 0.0 111.192 171.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 82.4 mt -61.55 -43.41 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.461 0.573 . . . . 0.0 110.798 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.62 -51.81 67.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.577 0.751 . . . . 0.0 112.267 177.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -69.09 -34.51 75.23 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.137 -0.977 . . . . 0.0 112.198 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -62.81 -50.87 69.29 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.374 0.67 . . . . 0.0 111.395 171.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 58.2 t90 -51.65 -44.58 63.05 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.043 0.838 . . . . 0.0 111.638 170.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.12 -46.38 87.55 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.396 0.998 . . . . 0.0 111.6 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -60.86 -47.99 83.85 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.566 0.747 . . . . 0.0 112.459 174.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -60.62 -51.34 69.83 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.573 -0.704 . . . . 0.0 111.201 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -62.32 -31.92 72.61 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.271 1.428 . . . . 0.0 112.914 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.5 tptt -60.96 -45.68 93.78 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.7 1.137 . . . . 0.0 112.345 165.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.1 t -77.7 -35.41 52.17 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -147.78 105.79 3.7 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 128.666 2.786 . . . . 0.0 108.946 -172.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.24 -14.28 25.66 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.901 3.067 . . . . 0.0 116.732 -157.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -68.47 -24.05 64.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -171.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.7 tp -68.66 140.4 55.46 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -98.13 153.95 18.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.92 1.288 . . . . 0.0 112.928 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -101.09 118.53 37.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.912 1.685 . . . . 0.0 109.329 178.539 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -135.93 119.44 16.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.492 1.117 . . . . 0.0 111.323 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' MET . . . . . 0.415 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.67 52.04 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.456 1.122 . . . . 0.0 113.377 -173.893 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.5 m -67.64 159.45 29.93 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.298 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -53.46 -37.0 62.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.094 -1.003 . . . . 0.0 112.596 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -61.86 -38.73 89.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.684 0.794 . . . . 0.0 113.06 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.59 91.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.994 0.815 . . . . 0.0 111.036 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.35 -47.69 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 119.177 -0.44 . . . . 0.0 110.464 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -67.97 -31.14 70.64 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.632 0.651 . . . . 0.0 112.568 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -70.12 -40.7 74.7 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.452 -0.78 . . . . 0.0 112.667 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -77.1 -33.49 56.93 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -133.41 83.65 48.93 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.923 1.689 . . . . 0.0 110.338 -171.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.43 -12.68 34.07 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.253 2.635 . . . . 0.0 114.563 -169.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -77.49 -7.19 55.84 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.74 -30.49 21.59 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.281 0.946 . . . . 0.0 113.41 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.227 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.56 153.86 21.72 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.1 mt -125.62 149.31 48.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.405 1.482 . . . . 0.0 112.06 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.85 142.01 53.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.878 0.871 . . . . 0.0 110.557 164.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.88 -8.47 15.96 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.14 161.85 40.04 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.29 1.036 . . . . 0.0 113.548 -173.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.05 -164.82 49.66 Favored Glycine 0 CA--C 1.542 1.75 0 C-N-CA 124.3 0.952 . . . . 0.0 114.378 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.78 -24.32 71.05 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.582 2.855 . . . . 0.0 113.85 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.43 -8.09 59.63 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.907 1.683 . . . . 0.0 113.861 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.47 125.67 16.99 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.654 1.116 . . . . 0.0 111.971 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.64 -1.25 78.43 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 116.189 1.236 . . . . 0.0 116.189 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.2 mt -107.37 153.9 40.95 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.02 1.41 . . . . 0.0 112.292 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -55.6 143.15 80.23 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.231 3.287 . . . . 0.0 113.193 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -79.45 -33.39 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 122.412 0.285 . . . . 0.0 111.002 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -133.31 165.36 25.0 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.3 mtt85 -52.78 -42.19 64.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.842 1.257 . . . . 0.0 111.397 170.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.4 m -71.52 -36.76 71.15 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.838 0.855 . . . . 0.0 113.116 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -61.62 -43.94 97.92 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.917 1.235 . . . . 0.0 110.502 171.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.42 -47.61 83.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.318 0.647 . . . . 0.0 112.447 178.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -55.18 -46.47 75.8 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.096 1.358 . . . . 0.0 111.845 174.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.0 t -77.29 -31.49 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 118.404 -0.808 . . . . 0.0 112.27 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.1 mt -63.43 -43.57 97.05 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.491 1.496 . . . . 0.0 111.444 169.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.9 mt -63.43 -42.2 95.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 118.257 0.48 . . . . 0.0 110.552 174.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -60.27 -49.23 78.43 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.539 0.609 . . . . 0.0 112.619 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.83 -46.19 91.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.96 0.904 . . . . 0.0 110.676 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -59.57 -52.19 66.61 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.633 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.431 ' CH2' ' HE2' ' A' ' 91' ' ' LYS . 66.1 t90 -52.99 -43.42 66.42 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.814 1.188 . . . . 0.0 112.359 175.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -68.21 -43.32 78.28 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.226 0.921 . . . . 0.0 111.835 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -63.9 -46.62 84.03 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.337 -0.852 . . . . 0.0 112.079 174.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -56.72 -48.29 78.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.521 0.728 . . . . 0.0 110.306 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.431 ' HE2' ' CH2' ' A' ' 87' ' ' TRP . 1.2 tmmt? -56.08 -39.42 72.07 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.493 1.517 . . . . 0.0 112.501 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 mtpt -66.03 -37.6 86.3 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.888 1.222 . . . . 0.0 112.728 172.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.3 m -74.57 -39.29 62.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -153.59 104.97 2.53 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 128.387 2.675 . . . . 0.0 109.297 -170.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.53 -14.21 20.1 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.613 2.875 . . . . 0.0 116.506 -160.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.3 p-90 -66.76 -22.43 66.04 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -172.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -63.38 141.4 58.78 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.739 0.7 . . . . 0.0 112.428 -166.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -95.93 141.59 29.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.661 1.184 . . . . 0.0 111.536 174.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.405 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -91.44 117.48 29.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.752 1.221 . . . . 0.0 109.234 176.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -133.93 118.1 17.51 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.473 1.109 . . . . 0.0 111.559 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.405 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.58 57.13 0.81 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.61 1.195 . . . . 0.0 112.454 -177.577 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 98.7 p -63.11 159.15 17.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.318 162.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -52.86 -39.9 62.96 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.133 -0.98 . . . . 0.0 111.381 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.97 -40.78 96.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.329 1.052 . . . . 0.0 112.77 173.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -38.76 85.94 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.887 1.221 . . . . 0.0 111.935 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.04 -47.16 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 118.854 -0.594 . . . . 0.0 110.257 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -71.73 -27.06 62.74 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.102 0.864 . . . . 0.0 112.959 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -71.48 -40.0 70.54 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.396 1.078 . . . . 0.0 112.727 172.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -74.85 -38.44 61.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -132.86 80.8 59.96 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.959 1.704 . . . . 0.0 110.231 -168.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.37 -12.54 35.21 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.24 2.627 . . . . 0.0 114.746 -168.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -78.23 -8.65 58.6 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -78.02 -36.79 48.29 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.437 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 126.587 1.955 . . . . 0.0 115.084 170.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.565 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.8 153.55 25.2 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.413 1.485 . . . . 0.0 113.916 174.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.3 mt -121.33 149.92 42.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.36 1.464 . . . . 0.0 111.512 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -67.66 140.33 56.81 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.335 0.654 . . . . 0.0 110.123 162.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.16 -17.28 15.43 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.26 159.92 41.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.661 1.184 . . . . 0.0 112.835 -170.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.82 -164.26 53.36 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.354 0.978 . . . . 0.0 114.51 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.94 -24.15 75.28 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.555 2.837 . . . . 0.0 113.949 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.89 -6.78 59.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.723 1.609 . . . . 0.0 113.553 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.43 125.54 16.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.774 1.17 . . . . 0.0 112.104 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.88 -1.34 77.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 116.126 1.21 . . . . 0.0 116.126 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.3 mt -107.34 152.82 41.39 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 119.116 1.458 . . . . 0.0 112.289 -174.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -58.19 144.33 95.59 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 124.326 3.35 . . . . 0.0 112.874 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.0 t -79.48 -36.19 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 121.91 -0.493 . . . . 0.0 111.354 177.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -141.58 168.5 19.62 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.519 1.527 . . . . 0.0 112.874 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.9 -36.09 64.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.121 1.368 . . . . 0.0 111.99 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -60.31 -40.18 89.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.731 0.813 . . . . 0.0 112.262 174.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -68.17 -46.1 71.67 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.761 -0.587 . . . . 0.0 110.277 174.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.14 88.1 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.482 0.583 . . . . 0.0 112.106 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -62.69 -48.44 79.29 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.293 1.437 . . . . 0.0 111.466 177.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 57.2 t -70.28 -32.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.125 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.48 -46.03 88.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.434 1.47 . . . . 0.0 111.655 172.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -66.28 -38.11 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 118.822 0.737 . . . . 0.0 110.9 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -61.37 -50.57 72.35 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.535 -0.728 . . . . 0.0 111.977 174.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -62.9 -36.99 85.16 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.213 0.605 . . . . 0.0 111.957 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.18 -57.23 13.97 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.869 0.868 . . . . 0.0 111.152 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -54.11 -46.08 72.03 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.041 0.837 . . . . 0.0 111.942 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.21 -46.64 79.86 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.66 0.664 . . . . 0.0 111.793 -173.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.15 -46.19 85.16 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.514 0.726 . . . . 0.0 111.615 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -58.81 -50.78 72.68 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 122.01 -0.431 . . . . 0.0 110.944 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -54.79 -40.61 69.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.025 1.33 . . . . 0.0 112.236 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -69.63 -31.46 69.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.942 0.897 . . . . 0.0 113.02 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.4 m -82.67 -31.47 28.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -149.11 104.28 3.35 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 127.779 2.432 . . . . 0.0 109.43 -169.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.47 4.42 5.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.878 3.719 . . . . 0.0 116.717 -157.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 p-90 -89.63 -23.38 21.93 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.6 tp -65.89 140.01 58.32 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -158.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -92.18 138.64 31.36 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.201 1.0 . . . . 0.0 111.606 172.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.1 tt -84.37 117.13 23.41 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.66 1.184 . . . . 0.0 108.274 175.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -123.59 112.42 17.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.777 0.831 . . . . 0.0 110.94 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -152.28 141.95 21.85 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.298 1.047 . . . . 0.0 112.49 164.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.3 t -157.79 170.1 23.12 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 128.993 2.917 . . . . 0.0 107.217 173.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -49.7 -39.28 36.39 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.12 -0.988 . . . . 0.0 112.592 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -61.39 -44.06 97.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 112.1 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.51 -39.67 94.21 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.604 0.762 . . . . 0.0 112.028 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.29 -46.58 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 122.001 -0.437 . . . . 0.0 109.969 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -71.24 -21.36 62.12 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -79.81 -42.78 23.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.872 1.269 . . . . 0.0 112.76 172.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.61 -42.37 82.53 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.664 0.665 . . . . 0.0 112.248 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -127.84 84.69 62.61 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.36 1.464 . . . . 0.0 109.952 -166.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -69.25 -11.1 30.7 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.298 2.666 . . . . 0.0 114.485 -167.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.2 p-80 -82.67 -7.4 59.65 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 175.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.08 -35.21 28.88 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.349 0.977 . . . . 0.0 112.641 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.0 ptt180 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 117.792 -1.099 . . . . 0.0 113.086 168.722 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.561 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -116.81 150.73 37.86 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.5 mt -123.13 149.86 43.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.843 1.657 . . . . 0.0 112.176 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -70.34 141.56 52.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.109 0.964 . . . . 0.0 110.45 162.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.07 -17.1 15.07 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -172.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.99 159.98 40.85 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.58 1.152 . . . . 0.0 112.982 -170.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.46 -163.41 53.09 Favored Glycine 0 CA--C 1.542 1.755 0 C-N-CA 124.396 0.998 . . . . 0.0 114.397 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -59.73 -24.11 74.36 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.524 2.816 . . . . 0.0 113.86 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -5.98 59.34 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.659 1.583 . . . . 0.0 113.641 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.73 17.69 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.87 1.213 . . . . 0.0 112.148 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.75 -1.15 80.76 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 115.904 1.122 . . . . 0.0 115.904 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.4 mt -107.1 153.1 41.21 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.009 1.404 . . . . 0.0 112.221 -174.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -57.08 143.91 91.54 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.311 3.341 . . . . 0.0 113.123 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.4 t -78.13 -29.46 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.308 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -139.02 166.44 24.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.584 1.154 . . . . 0.0 112.86 -173.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.42 -34.69 72.8 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.612 -0.68 . . . . 0.0 111.989 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.7 t -70.76 -39.47 73.23 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.06 0.544 . . . . 0.0 111.728 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.17 -44.66 96.11 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.367 -0.833 . . . . 0.0 110.722 171.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.26 -47.18 87.09 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.546 -0.721 . . . . 0.0 112.641 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -56.55 -47.12 80.14 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.643 . . . . 0.0 111.891 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 43.3 t -77.45 -30.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 118.342 -0.837 . . . . 0.0 112.613 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.04 -44.64 97.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.721 1.601 . . . . 0.0 111.22 169.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.53 -41.41 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.367 0.53 . . . . 0.0 110.952 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -60.29 -48.76 80.38 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.945 0.793 . . . . 0.0 112.288 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -64.71 -39.81 94.29 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 118.949 0.795 . . . . 0.0 111.989 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -58.68 -53.16 61.52 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.944 0.897 . . . . 0.0 111.146 171.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -55.56 -45.54 77.28 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.74 174.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -48.72 79.88 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.514 1.052 . . . . 0.0 111.733 -175.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.29 -49.33 77.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.027 0.531 . . . . 0.0 111.654 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -59.21 -52.49 65.47 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 119.093 -0.479 . . . . 0.0 111.144 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -51.87 -44.1 63.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.163 1.785 . . . . 0.0 112.282 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -73.3 -26.06 60.91 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -85.95 -29.49 23.54 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 169.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -151.37 105.1 2.93 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 128.387 2.675 . . . . 0.0 109.433 -168.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.2 -11.6 23.1 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 124.169 3.246 . . . . 0.0 116.583 -160.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -68.2 -25.78 65.4 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -172.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.8 tp -70.82 144.82 50.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -158.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -105.6 143.56 33.59 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.928 1.691 . . . . 0.0 111.594 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -93.31 119.31 32.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.202 1.401 . . . . 0.0 109.73 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -135.15 120.01 18.49 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.535 1.134 . . . . 0.0 111.672 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.421 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.67 50.13 0.75 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.786 1.234 . . . . 0.0 112.962 -176.649 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.0 m -66.96 161.5 24.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.683 0.793 . . . . 0.0 111.354 164.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -51.66 -39.57 58.42 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.179 -0.951 . . . . 0.0 112.99 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.7 -41.19 94.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 112.729 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.07 -38.73 91.73 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.218 0.917 . . . . 0.0 111.715 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.81 -46.95 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.289 177.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -69.98 -29.45 66.56 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -72.14 -40.23 68.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.162 0.985 . . . . 0.0 112.827 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -74.15 -41.56 61.33 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.805 0.729 . . . . 0.0 112.138 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -128.17 91.63 43.9 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.32 1.848 . . . . 0.0 110.282 -172.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.26 -14.98 35.1 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.182 2.588 . . . . 0.0 114.669 -167.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -81.23 -5.54 57.87 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.27 -29.04 21.95 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 . . . . . 0 C--O 1.256 1.403 0 CA-C-N 119.62 1.1 . . . . 0.0 112.881 178.327 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.614 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.56 152.11 22.8 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.34 150.66 46.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.737 1.615 . . . . 0.0 112.128 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -69.72 132.16 45.7 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.745 0.818 . . . . 0.0 109.981 162.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -25.57 17.37 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.27 164.36 30.46 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.195 1.398 . . . . 0.0 112.392 -171.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.46 -166.16 54.62 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.292 0.948 . . . . 0.0 114.48 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.26 -28.64 72.53 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.033 3.156 . . . . 0.0 114.646 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.12 2.95 55.22 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.046 1.338 . . . . 0.0 113.511 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.69 127.1 15.15 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 119.133 0.879 . . . . 0.0 112.323 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.45 -3.64 79.27 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 115.953 1.141 . . . . 0.0 115.953 -177.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 mt -107.37 155.04 40.22 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 118.966 1.383 . . . . 0.0 112.56 -172.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -57.19 144.41 90.63 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.278 3.319 . . . . 0.0 113.015 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 38.2 t -80.11 -28.81 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 122.376 0.27 . . . . 0.0 111.327 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.4 p -139.15 166.08 25.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.574 1.15 . . . . 0.0 112.88 -173.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -60.79 -36.41 78.93 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 173.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.9 t -65.21 -44.87 86.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.849 0.86 . . . . 0.0 111.36 174.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -60.89 -43.55 98.31 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.469 -0.769 . . . . 0.0 111.078 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.34 81.21 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.47 -0.769 . . . . 0.0 112.634 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.5 ttt85 -61.16 -41.5 96.88 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.937 1.295 . . . . 0.0 111.893 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.31 -34.26 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.182 -0.914 . . . . 0.0 112.211 177.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 47.0 mt -61.31 -45.64 93.6 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.878 1.672 . . . . 0.0 111.355 171.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.17 -43.87 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 117.974 0.352 . . . . 0.0 110.47 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -58.62 -49.79 76.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.256 0.48 . . . . 0.0 112.12 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.31 -36.47 71.63 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.521 -0.737 . . . . 0.0 112.271 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -60.84 -50.78 72.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 118.463 -0.78 . . . . 0.0 110.728 169.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -53.18 -43.7 67.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.419 1.009 . . . . 0.0 111.665 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -63.67 -45.04 91.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 120.076 1.307 . . . . 0.0 112.237 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.1 -46.27 81.76 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.545 -0.722 . . . . 0.0 112.615 173.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -59.87 -48.09 83.09 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.592 -0.693 . . . . 0.0 110.493 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -57.34 -42.15 81.39 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.255 1.822 . . . . 0.0 111.986 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -59.55 -44.93 93.11 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.311 0.645 . . . . 0.0 112.451 170.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.7 m -77.09 -29.16 54.83 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -151.43 107.35 2.94 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 127.806 2.443 . . . . 0.0 109.312 -168.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.23 -14.48 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.826 3.017 . . . . 0.0 116.113 -160.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -70.96 -25.37 62.69 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -171.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -67.66 145.97 54.28 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -157.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -109.51 144.92 37.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.261 1.824 . . . . 0.0 111.5 173.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.46 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -98.18 122.2 41.04 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.85 1.66 . . . . 0.0 109.995 -177.199 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -137.59 120.35 16.31 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.658 1.183 . . . . 0.0 111.882 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.46 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.11 55.24 0.65 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.512 1.125 . . . . 0.0 113.385 -176.091 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.3 t -66.14 157.01 32.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.611 0.764 . . . . 0.0 110.913 161.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -54.26 -32.43 56.1 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.905 -1.122 . . . . 0.0 112.719 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.23 -41.32 96.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.062 0.945 . . . . 0.0 112.579 171.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.01 -38.22 87.92 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.601 0.76 . . . . 0.0 111.73 174.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.71 -47.14 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.302 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.76 -32.37 72.92 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.777 0.717 . . . . 0.0 112.385 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -69.02 -40.82 78.44 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.586 0.754 . . . . 0.0 112.625 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 78.6 mtt-85 -72.72 -39.32 67.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.965 0.906 . . . . 0.0 112.736 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -133.67 85.06 43.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.155 1.782 . . . . 0.0 109.979 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.97 -13.74 37.2 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.25 2.633 . . . . 0.0 114.611 -167.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -77.29 -8.86 58.32 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.78 -29.59 23.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 . . . . . 0 C--O 1.254 1.316 0 CA-C-N 119.42 1.009 . . . . 0.0 112.94 179.002 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -103.95 150.54 24.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.98 148.83 45.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.488 1.515 . . . . 0.0 112.02 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.62 142.05 53.56 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.057 0.943 . . . . 0.0 110.462 162.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.0 -15.57 15.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -137.95 158.64 43.92 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.462 1.105 . . . . 0.0 113.388 -169.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.79 -161.93 51.19 Favored Glycine 0 CA--C 1.542 1.724 0 C-N-CA 124.494 1.045 . . . . 0.0 114.411 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.16 -24.33 73.36 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.441 2.761 . . . . 0.0 113.91 179.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.78 -6.85 59.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.541 1.537 . . . . 0.0 113.523 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 125.09 16.05 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.007 1.276 . . . . 0.0 112.056 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.89 -0.5 79.47 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 116.121 1.208 . . . . 0.0 116.121 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 27.7 mt -106.56 152.96 40.86 Favored Pre-proline 0 CA--C 1.55 0.963 0 CA-C-N 118.924 1.362 . . . . 0.0 112.284 -174.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -56.97 143.42 92.44 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.505 3.47 . . . . 0.0 112.952 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.1 t -77.96 -39.33 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.899 -0.5 . . . . 0.0 111.452 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.1 t -134.67 164.15 28.17 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.254 1.422 . . . . 0.0 112.678 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -59.97 -27.23 66.66 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.003 -1.061 . . . . 0.0 112.833 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.5 m -68.86 -35.34 76.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 171.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -65.17 -44.56 88.08 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.257 0.935 . . . . 0.0 109.736 169.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.99 93.37 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 -56.32 -48.54 76.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.822 1.649 . . . . 0.0 111.502 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.5 t -73.89 -33.45 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 118.546 -0.74 . . . . 0.0 112.186 -178.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.13 -47.97 82.2 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 120.262 1.392 . . . . 0.0 111.1 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.77 -43.37 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 122.885 0.474 . . . . 0.0 110.789 175.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -59.5 -52.47 65.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.747 0.819 . . . . 0.0 112.41 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -68.56 -34.65 76.2 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.678 -0.639 . . . . 0.0 112.337 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -61.47 -53.21 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.14 170.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -52.17 -45.74 65.23 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.359 172.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -64.87 -42.1 95.13 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.646 1.112 . . . . 0.0 112.679 -175.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -62.97 -47.98 80.84 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.896 0.771 . . . . 0.0 111.506 173.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.0 mmp_? -59.66 -50.84 72.3 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.715 -0.616 . . . . 0.0 110.918 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -52.46 -41.34 63.23 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.596 1.959 . . . . 0.0 112.6 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -67.59 -36.73 81.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.116 . . . . 0.0 111.874 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 t -79.49 -33.23 42.36 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 176.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -152.98 112.14 2.69 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 128.427 2.691 . . . . 0.0 109.669 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.94 -11.64 18.0 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 124.34 3.36 . . . . 0.0 116.401 -161.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -66.74 -24.84 66.28 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -172.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.91 144.16 49.07 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -159.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -103.04 147.94 26.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.048 1.739 . . . . 0.0 112.174 171.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.417 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -98.97 118.24 35.29 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.543 1.537 . . . . 0.0 109.26 -179.709 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -134.34 115.35 13.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.38 1.072 . . . . 0.0 111.922 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.417 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.13 49.43 0.78 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.84 1.256 . . . . 0.0 112.997 -175.369 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.1 t -64.21 156.31 29.11 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.809 162.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -50.28 -36.89 33.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.447 1.099 . . . . 0.0 112.029 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -61.74 -42.45 98.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.137 0.975 . . . . 0.0 112.251 174.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.04 89.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.695 0.679 . . . . 0.0 111.49 174.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.4 -45.74 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.996 -0.44 . . . . 0.0 110.342 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -68.01 -31.49 71.21 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -72.1 -40.26 68.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.281 1.032 . . . . 0.0 112.835 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -74.31 -37.28 63.67 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.754 0.822 . . . . 0.0 112.802 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -132.95 88.59 36.71 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.857 1.663 . . . . 0.0 110.205 -170.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -70.21 -10.56 28.48 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.329 2.686 . . . . 0.0 114.819 -166.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -82.81 -6.61 59.51 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.64 -32.45 23.66 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.365 0.984 . . . . 0.0 113.217 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 . . . . . 0 C--O 1.256 1.395 0 C-N-CA 123.839 0.856 . . . . 0.0 113.127 169.54 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.482 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.49 152.63 23.41 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -124.14 150.43 45.12 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.582 1.553 . . . . 0.0 111.83 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -68.34 131.66 45.71 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.543 0.737 . . . . 0.0 110.182 164.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.3 -18.4 22.49 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.49 167.49 27.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 112.904 -173.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.62 -168.86 54.81 Favored Glycine 0 CA--C 1.542 1.73 0 C-N-CA 124.105 0.86 . . . . 0.0 114.571 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.6 -28.51 75.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.166 3.244 . . . . 0.0 114.542 -174.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.3 mt -95.47 3.76 53.93 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.996 1.318 . . . . 0.0 113.507 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.29 128.94 17.79 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.941 0.791 . . . . 0.0 112.489 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.59 -5.25 82.46 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 -176.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.5 mt -106.82 155.97 38.11 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 118.919 1.359 . . . . 0.0 112.166 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -56.89 142.31 93.04 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.099 3.199 . . . . 0.0 112.88 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -78.35 -32.05 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.91 174.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -134.23 166.52 22.59 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.468 1.107 . . . . 0.0 113.304 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -62.74 -36.24 82.39 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.436 -0.79 . . . . 0.0 111.269 173.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -65.23 -41.34 94.47 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.064 0.946 . . . . 0.0 111.823 173.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -60.54 -46.0 91.79 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.878 0.763 . . . . 0.0 110.452 172.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.1 91.5 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -57.35 -46.55 83.19 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.711 1.204 . . . . 0.0 111.218 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.5 t -73.15 -32.45 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.717 0.807 . . . . 0.0 112.428 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.4 mt -62.15 -47.19 85.64 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 120.27 1.395 . . . . 0.0 110.955 170.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.05 -41.24 92.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 118.833 0.742 . . . . 0.0 110.675 176.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -59.85 -51.22 70.66 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -66.85 -39.76 87.69 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.698 -0.626 . . . . 0.0 111.521 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -56.99 -52.74 64.04 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.821 0.848 . . . . 0.0 111.201 172.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -52.52 -45.24 66.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.298 -0.858 . . . . 0.0 112.12 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -68.88 -40.67 79.09 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.717 1.144 . . . . 0.0 112.8 -174.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.72 -45.47 89.8 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.212 -0.93 . . . . 0.0 112.004 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -58.37 -52.1 67.03 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.763 -0.586 . . . . 0.0 110.653 174.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.46 -40.61 51.26 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 126.432 1.893 . . . . 0.0 112.509 173.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -69.63 -34.23 73.75 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.076 0.95 . . . . 0.0 111.771 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.0 t -78.44 -37.89 42.58 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 173.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -153.47 108.73 2.58 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.797 2.839 . . . . 0.0 109.584 -171.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 -13.87 18.35 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.007 3.138 . . . . 0.0 116.656 -160.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -65.09 -25.33 67.75 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.294 1.591 . . . . 0.0 115.294 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 34.0 tp -65.61 142.89 57.91 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -162.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 68.7 mtp85 -87.04 148.06 25.44 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.505 1.122 . . . . 0.0 113.163 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.31 108.25 19.83 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.852 1.261 . . . . 0.0 108.754 167.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -132.31 122.92 25.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.819 1.248 . . . . 0.0 110.005 173.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.83 64.21 0.79 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -175.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -65.63 162.87 17.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.076 0.95 . . . . 0.0 112.155 166.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -53.96 -36.5 62.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.849 -1.157 . . . . 0.0 111.784 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -62.77 -40.97 98.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.974 0.91 . . . . 0.0 112.402 172.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.27 91.27 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.639 1.109 . . . . 0.0 112.059 172.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -47.3 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.143 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -69.15 -30.93 69.27 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.018 0.826 . . . . 0.0 112.491 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -70.33 -37.77 74.76 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.296 1.038 . . . . 0.0 112.943 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.9 -42.73 63.27 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 119.042 0.837 . . . . 0.0 112.816 169.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -132.33 84.16 52.82 Favored Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 125.814 1.646 . . . . 0.0 110.131 -163.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.6 -14.95 40.68 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.245 2.63 . . . . 0.0 114.506 -166.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -77.17 -8.28 57.27 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.84 -21.43 23.71 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 . . . . . 0 C--O 1.253 1.282 0 CA-C-N 119.871 1.214 . . . . 0.0 112.451 175.692 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.48 154.47 32.46 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 114.538 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -126.05 149.13 49.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 112.085 -177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -70.64 142.38 51.63 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.025 0.93 . . . . 0.0 110.485 162.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.67 -14.14 14.88 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.55 158.23 44.64 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.596 1.159 . . . . 0.0 113.034 -171.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.38 -162.86 51.72 Favored Glycine 0 CA--C 1.54 1.638 0 C-N-CA 124.373 0.987 . . . . 0.0 114.442 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.3 -24.42 74.21 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.627 2.885 . . . . 0.0 113.871 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.25 -7.38 59.61 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.638 1.575 . . . . 0.0 113.68 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.41 16.88 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.796 1.18 . . . . 0.0 112.061 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.14 -0.76 79.1 Favored Glycine 0 CA--C 1.53 1.01 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.11 153.55 40.95 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 119.002 1.401 . . . . 0.0 112.144 -174.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -56.16 142.84 86.28 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 124.327 3.351 . . . . 0.0 113.071 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.2 t -77.32 -33.76 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.746 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.9 p -133.84 164.45 27.22 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.614 1.166 . . . . 0.0 113.274 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -60.57 -31.28 70.41 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.332 -0.855 . . . . 0.0 112.685 172.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.6 m -69.42 -41.42 76.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.66 173.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.25 -45.05 96.14 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.708 0.685 . . . . 0.0 110.463 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.62 85.34 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.507 0.723 . . . . 0.0 112.251 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -56.64 -45.62 81.49 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.885 1.274 . . . . 0.0 111.797 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.33 -33.87 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.532 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.85 -44.08 97.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.409 1.458 . . . . 0.0 111.193 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.43 -42.49 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.528 0.603 . . . . 0.0 110.8 174.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -60.57 -50.15 74.67 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.79 -0.569 . . . . 0.0 112.286 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -69.09 -35.1 76.1 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.571 -0.706 . . . . 0.0 112.234 -177.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.55 -56.24 23.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.262 1.025 . . . . 0.0 110.541 169.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -52.87 -45.61 67.51 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.911 173.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -67.42 -41.75 84.31 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.344 0.975 . . . . 0.0 112.238 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.49 -43.98 79.64 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.214 -0.929 . . . . 0.0 111.611 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.6 -49.56 76.01 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.654 -0.654 . . . . 0.0 110.759 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -54.96 -43.05 73.11 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.396 1.878 . . . . 0.0 112.453 175.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -63.33 -36.99 85.53 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.675 0.79 . . . . 0.0 112.146 175.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.6 m -77.64 -36.71 51.22 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -152.93 103.99 2.65 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 128.094 2.558 . . . . 0.0 109.788 -168.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.67 -13.32 22.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.095 3.197 . . . . 0.0 116.679 -160.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -65.5 -24.2 67.08 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -172.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.64 146.61 54.6 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -163.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -100.42 150.95 22.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.252 1.421 . . . . 0.0 113.232 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.409 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -109.37 117.87 35.17 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.791 1.636 . . . . 0.0 109.535 -177.451 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.29 120.48 18.9 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.555 1.142 . . . . 0.0 111.613 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.409 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -151.51 53.08 0.83 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.589 1.156 . . . . 0.0 113.043 -176.128 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.8 t -67.8 157.09 35.57 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.785 160.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -54.3 -31.6 54.44 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.853 -1.154 . . . . 0.0 112.781 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -61.52 -41.54 97.48 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 112.036 172.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.95 -38.73 89.36 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.798 0.839 . . . . 0.0 111.849 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.61 -47.44 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.318 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -67.92 -32.59 73.15 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.624 0.647 . . . . 0.0 112.264 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -69.8 -39.24 76.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.626 -0.672 . . . . 0.0 112.601 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 -71.82 -41.95 67.61 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.694 0.679 . . . . 0.0 112.649 172.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.77 83.31 61.95 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.701 1.601 . . . . 0.0 110.133 -165.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.35 -14.66 40.73 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 -166.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.7 p-80 -77.49 -8.32 57.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.52 -29.56 25.85 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.489 1.04 . . . . 0.0 113.593 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.066 0.947 . . . . 0.0 112.741 177.509 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -100.4 140.84 34.08 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 174.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.48 152.06 50.14 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.614 1.566 . . . . 0.0 112.219 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -68.11 145.39 54.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.455 1.502 . . . . 0.0 111.343 175.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.2 -13.79 14.84 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -138.76 158.96 43.26 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.568 1.147 . . . . 0.0 112.93 -171.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.19 -164.09 52.3 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 124.396 0.998 . . . . 0.0 114.436 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.98 -23.79 74.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.404 2.736 . . . . 0.0 113.844 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mp -84.27 -5.66 59.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.532 1.533 . . . . 0.0 113.76 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.91 127.28 23.13 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.992 1.269 . . . . 0.0 112.147 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.28 -7.67 80.2 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.724 1.154 . . . . 0.0 115.698 -176.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.7 mt -104.43 149.65 37.61 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 118.893 1.347 . . . . 0.0 112.058 -170.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -58.76 146.43 92.59 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 124.371 3.381 . . . . 0.0 113.019 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.85 -28.63 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.397 175.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 p -140.3 167.2 22.69 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.468 1.107 . . . . 0.0 112.823 -172.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -65.61 -33.94 77.07 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.854 0.862 . . . . 0.0 111.772 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.8 t -69.05 -42.03 76.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.561 0.744 . . . . 0.0 111.83 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -64.6 -38.46 91.07 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.502 -0.749 . . . . 0.0 111.466 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.65 -46.37 90.05 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.45 -0.781 . . . . 0.0 112.419 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -56.1 -44.49 79.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.232 1.413 . . . . 0.0 112.016 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.03 -35.44 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-O 118.4 -0.809 . . . . 0.0 112.149 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.33 -44.18 97.08 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.616 1.553 . . . . 0.0 111.361 172.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.76 -40.94 90.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 118.286 0.494 . . . . 0.0 110.863 174.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.94 -46.69 88.22 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.563 -0.711 . . . . 0.0 112.578 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.17 -38.37 90.34 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.496 0.719 . . . . 0.0 111.632 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -59.65 -55.85 29.3 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.005 169.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -54.14 -42.11 69.18 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.605 1.093 . . . . 0.0 112.692 177.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.96 -49.44 77.69 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.767 1.167 . . . . 0.0 112.649 175.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.92 -49.61 77.03 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.276 -0.89 . . . . 0.0 111.489 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmt-85 -61.22 -49.37 77.4 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.984 0.913 . . . . 0.0 110.372 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.36 -38.12 79.62 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.188 1.395 . . . . 0.0 112.565 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -66.12 -37.49 85.85 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.088 0.858 . . . . 0.0 112.311 173.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.1 m -76.81 -36.78 56.69 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -153.49 104.38 2.55 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 128.174 2.59 . . . . 0.0 109.617 -168.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.88 -13.01 24.16 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.041 3.16 . . . . 0.0 116.65 -160.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -67.94 -24.12 65.14 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -171.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -65.25 143.1 58.03 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -161.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -93.37 147.37 22.99 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.901 1.28 . . . . 0.0 111.862 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.82 118.03 36.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.497 1.519 . . . . 0.0 109.276 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.6 115.53 14.79 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.404 1.082 . . . . 0.0 111.721 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.68 49.43 0.87 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.809 1.244 . . . . 0.0 112.973 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.3 t -64.6 157.08 27.98 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.72 160.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -51.7 -38.97 57.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.212 1.005 . . . . 0.0 112.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -62.65 -37.04 84.8 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.854 0.862 . . . . 0.0 113.091 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.28 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 118.933 0.788 . . . . 0.0 111.417 173.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.53 -47.61 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.151 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -69.31 -29.56 67.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.846 0.748 . . . . 0.0 112.269 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -74.4 -36.14 63.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 175.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -78.25 -39.7 39.44 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.266 0.939 . . . . 0.0 111.967 174.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -127.36 90.29 49.18 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.313 1.845 . . . . 0.0 110.329 -172.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -71.28 -12.68 30.21 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.204 2.603 . . . . 0.0 115.086 -165.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -82.68 -5.07 58.66 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.77 -19.68 28.72 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-N 119.904 1.229 . . . . 0.0 111.167 165.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.82 153.98 33.62 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.284 1.434 . . . . 0.0 114.423 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.6 mt -124.41 149.2 46.99 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.411 1.484 . . . . 0.0 111.884 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.31 140.35 54.35 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.806 0.842 . . . . 0.0 110.182 162.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.9 -16.96 15.21 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.08 159.87 41.14 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.749 1.22 . . . . 0.0 112.959 -170.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.92 -164.1 53.59 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 124.335 0.969 . . . . 0.0 114.37 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.89 -24.15 75.14 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.611 2.874 . . . . 0.0 113.829 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -84.38 -6.19 59.36 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.826 1.65 . . . . 0.0 113.528 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.61 125.82 17.74 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 119.841 1.201 . . . . 0.0 112.13 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.35 -1.23 79.21 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 116.003 1.161 . . . . 0.0 116.003 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.5 mt -106.82 153.14 40.97 Favored Pre-proline 0 CA--C 1.55 0.957 0 CA-C-N 119.08 1.44 . . . . 0.0 112.382 -174.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -55.37 141.54 81.52 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 124.364 3.376 . . . . 0.0 112.901 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 t -76.44 -33.76 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.285 -0.259 . . . . 0.0 110.886 172.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.65 166.47 22.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.823 1.249 . . . . 0.0 113.015 -174.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -33.43 74.27 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.295 -0.878 . . . . 0.0 111.62 172.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.2 m -66.11 -40.11 90.48 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.48 0.712 . . . . 0.0 111.534 174.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -63.0 -45.63 91.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.771 0.714 . . . . 0.0 110.621 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.58 89.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.723 0.692 . . . . 0.0 112.386 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -54.18 -49.74 68.64 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.026 1.73 . . . . 0.0 111.254 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.25 -31.33 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.426 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.5 -47.44 83.96 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.431 1.469 . . . . 0.0 111.258 170.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.3 mt -62.14 -43.32 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.532 0.605 . . . . 0.0 110.69 175.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.37 -50.95 71.57 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.538 0.735 . . . . 0.0 112.325 177.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -69.04 -33.76 74.1 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.537 -0.727 . . . . 0.0 112.071 -177.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -60.43 -54.71 42.35 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.663 0.785 . . . . 0.0 110.86 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 64.0 t90 -49.83 -47.01 51.8 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.306 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -64.02 -46.46 84.38 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 120.113 1.324 . . . . 0.0 112.131 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.6 -45.59 89.63 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.555 -0.716 . . . . 0.0 111.894 175.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -57.33 -49.45 76.08 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.875 -0.516 . . . . 0.0 110.633 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt -55.62 -41.0 72.89 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.617 1.567 . . . . 0.0 112.183 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -65.76 -39.31 90.91 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -77.87 -32.75 52.15 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -155.44 111.32 2.23 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 128.288 2.635 . . . . 0.0 109.393 -166.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -75.59 -11.95 20.4 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 124.016 3.144 . . . . 0.0 116.359 -160.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.4 p-90 -67.82 -30.73 70.21 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -171.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.1 tt -72.36 141.57 48.77 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.487 0.715 . . . . 0.0 111.768 -156.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -114.55 142.23 46.7 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.357 1.463 . . . . 0.0 111.887 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.408 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -90.15 119.86 30.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.036 1.334 . . . . 0.0 110.304 -172.325 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.85 120.32 18.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.636 1.174 . . . . 0.0 111.741 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.408 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -150.19 54.76 0.92 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.962 1.305 . . . . 0.0 112.441 -177.478 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -63.79 163.41 11.76 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.346 1.058 . . . . 0.0 112.185 165.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -50.23 -44.0 53.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.996 0.919 . . . . 0.0 111.041 173.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -61.01 -44.36 97.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.466 1.106 . . . . 0.0 112.292 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -39.53 87.68 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.381 0.991 . . . . 0.0 112.464 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.69 -48.16 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.072 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -69.34 -27.17 65.12 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.815 0.734 . . . . 0.0 112.764 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -72.96 -42.02 63.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.661 1.184 . . . . 0.0 112.691 172.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.1 mtt85 -73.14 -37.42 66.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -134.84 82.63 43.26 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 126.067 1.747 . . . . 0.0 110.168 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.63 -12.13 33.81 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.32 2.68 . . . . 0.0 114.679 -168.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -79.05 -7.87 58.48 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.65 -31.14 26.34 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.611 1.096 . . . . 0.0 113.304 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 . . . . . 0 C--O 1.256 1.407 0 CA-C-N 119.386 0.994 . . . . 0.0 111.887 168.776 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.34 156.39 18.56 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -128.09 148.58 50.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -71.29 141.77 50.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.127 0.971 . . . . 0.0 110.412 163.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.59 -15.15 14.85 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.69 158.95 43.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.625 1.17 . . . . 0.0 113.087 -170.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.63 -162.84 52.08 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.444 1.021 . . . . 0.0 114.396 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.44 -24.04 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.469 2.779 . . . . 0.0 113.839 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.08 -6.61 59.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.723 1.609 . . . . 0.0 113.64 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.2 16.19 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.934 1.243 . . . . 0.0 112.029 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.26 -0.44 78.27 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 115.971 1.148 . . . . 0.0 115.971 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.7 mt -106.51 153.05 40.8 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 119.07 1.435 . . . . 0.0 112.537 -174.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -54.7 144.04 66.88 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.575 3.516 . . . . 0.0 113.213 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.7 t -80.91 -33.9 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 122.651 0.38 . . . . 0.0 110.896 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -130.97 165.77 22.43 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.763 1.225 . . . . 0.0 113.309 -175.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -62.82 -35.33 79.57 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.375 -0.828 . . . . 0.0 111.05 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.3 m -65.12 -41.46 94.86 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.157 0.983 . . . . 0.0 111.893 173.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -61.17 -46.39 90.68 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.957 0.799 . . . . 0.0 110.486 173.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.73 88.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.348 0.659 . . . . 0.0 112.51 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -61.57 -42.56 99.03 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.295 1.438 . . . . 0.0 112.099 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 67.6 t -73.83 -34.51 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.466 176.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.89 -44.21 96.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 120.492 1.496 . . . . 0.0 111.287 172.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.26 -42.99 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.214 0.461 . . . . 0.0 110.815 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -57.89 -52.81 63.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.744 0.702 . . . . 0.0 112.179 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -63.14 -41.17 99.24 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.719 0.69 . . . . 0.0 112.093 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.09 -51.21 71.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.989 0.516 . . . . 0.0 111.062 175.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.23 -45.36 72.28 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.915 171.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.12 -46.64 83.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.034 1.288 . . . . 0.0 112.204 -173.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -65.73 -42.84 90.57 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.443 -0.785 . . . . 0.0 111.882 176.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -60.4 -50.02 75.27 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.673 -0.642 . . . . 0.0 111.193 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -55.22 -40.85 71.31 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.972 1.709 . . . . 0.0 112.03 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -64.98 -40.17 94.58 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.59 0.756 . . . . 0.0 112.697 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.5 m -80.62 -29.31 36.81 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -150.98 110.15 3.07 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 128.225 2.61 . . . . 0.0 109.254 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.1 -11.52 21.3 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.765 2.977 . . . . 0.0 116.115 -161.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.7 p-90 -76.73 -19.94 57.1 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -170.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.33 147.85 45.91 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.455 1.025 . . . . 0.0 113.452 -164.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -114.02 149.66 35.07 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 125.124 1.37 . . . . 0.0 112.189 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.451 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -94.22 121.08 35.36 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.61 1.564 . . . . 0.0 109.681 -175.209 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -137.55 112.4 8.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.196 0.999 . . . . 0.0 111.945 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.451 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -149.47 51.69 0.94 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.833 1.253 . . . . 0.0 113.099 -177.025 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 t -66.2 157.34 31.65 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.74 160.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -52.71 -36.9 58.23 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.145 0.978 . . . . 0.0 112.338 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -63.58 -37.44 87.32 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.81 0.844 . . . . 0.0 112.491 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.39 91.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.962 0.801 . . . . 0.0 111.249 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.83 -46.5 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 119.018 -0.515 . . . . 0.0 110.228 177.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -71.15 -27.17 63.35 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.994 0.815 . . . . 0.0 112.719 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.67 -46.17 73.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 112.152 171.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -79.49 -30.8 42.15 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -134.4 77.79 58.91 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 126.173 1.789 . . . . 0.0 110.377 -172.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.42 -8.78 24.52 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.643 2.895 . . . . 0.0 114.997 -168.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -81.58 -9.5 59.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.54 -45.68 24.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.177 0.899 . . . . 0.0 111.848 177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 117.216 2.302 . . . . 0.0 117.216 177.558 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.577 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.7 159.12 16.46 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.611 1.565 . . . . 0.0 114.068 172.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.02 149.83 50.68 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.411 1.485 . . . . 0.0 111.538 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -68.85 130.3 42.39 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.311 0.644 . . . . 0.0 109.828 162.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.05 -24.07 17.75 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.26 164.11 31.14 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.363 1.465 . . . . 0.0 112.275 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.98 -167.41 54.67 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 124.179 0.895 . . . . 0.0 114.637 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.44 -28.32 72.59 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 124.114 3.209 . . . . 0.0 114.685 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.0 mt -95.63 2.96 54.39 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.081 1.353 . . . . 0.0 113.536 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.61 127.28 15.34 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.946 0.793 . . . . 0.0 112.396 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.81 -4.65 75.75 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -176.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.5 mt -107.11 155.4 39.35 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 118.932 1.366 . . . . 0.0 112.487 -173.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -55.04 145.5 63.42 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.337 3.358 . . . . 0.0 112.814 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.9 t -81.62 -32.05 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.062 -0.399 . . . . 0.0 110.778 171.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -134.45 167.26 21.08 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.783 1.233 . . . . 0.0 113.487 -175.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.2 mtm180 -62.57 -34.8 77.7 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 121.639 -0.663 . . . . 0.0 111.942 173.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 t -66.16 -42.73 88.6 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.607 0.763 . . . . 0.0 111.243 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -60.2 -46.71 88.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.676 -0.64 . . . . 0.0 110.672 173.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.91 88.63 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.706 0.802 . . . . 0.0 112.394 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -61.95 -42.05 98.67 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.56 1.144 . . . . 0.0 112.041 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 62.0 t -72.81 -35.08 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.336 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.06 -43.99 97.07 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.542 1.519 . . . . 0.0 111.294 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.76 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.529 0.604 . . . . 0.0 110.741 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.22 -50.26 74.35 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.841 0.746 . . . . 0.0 112.195 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -64.0 -38.52 91.38 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.438 0.695 . . . . 0.0 112.265 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.22 -53.79 53.49 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.992 0.917 . . . . 0.0 110.951 173.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 67.9 t90 -54.08 -46.27 72.0 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.264 173.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.76 -45.62 88.99 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.293 0.951 . . . . 0.0 112.39 -173.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -64.09 -49.42 72.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.758 0.823 . . . . 0.0 111.763 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -61.09 -49.15 78.49 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.817 -0.552 . . . . 0.0 111.252 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -56.93 -41.29 77.95 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.111 1.364 . . . . 0.0 112.817 175.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -64.01 -33.67 76.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.605 1.093 . . . . 0.0 112.777 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -77.6 -37.41 50.41 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 172.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -150.11 107.42 3.2 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 128.003 2.521 . . . . 0.0 109.952 -172.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.04 -12.33 23.62 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.338 3.359 . . . . 0.0 117.13 -157.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 21.7 p-90 -69.75 -19.79 63.52 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -172.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 36.1 tp -67.27 138.79 57.13 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -159.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -83.83 148.78 26.8 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.54 1.536 . . . . 0.0 111.72 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 tt -114.91 119.56 36.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.767 1.627 . . . . 0.0 109.15 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -139.12 114.5 9.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.468 1.107 . . . . 0.0 111.487 174.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.66 49.58 1.14 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.0 m -73.62 161.01 30.78 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.736 0.814 . . . . 0.0 110.993 160.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -51.84 -38.25 55.13 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.953 0.901 . . . . 0.0 113.175 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -60.0 -40.85 90.62 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.24 -38.17 89.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.74 -47.02 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.403 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -69.46 -31.79 70.31 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.947 0.794 . . . . 0.0 112.562 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -70.39 -37.2 74.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.841 0.857 . . . . 0.0 113.257 174.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -73.14 -41.22 64.2 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.03 0.832 . . . . 0.0 112.85 171.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.9 82.42 64.23 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.728 1.611 . . . . 0.0 110.156 -165.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -70.07 -10.11 27.56 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.484 2.789 . . . . 0.0 114.589 -167.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -78.52 -10.31 59.67 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.5 -31.64 32.77 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.508 1.049 . . . . 0.0 113.316 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 119.577 1.081 . . . . 0.0 112.728 171.975 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.16 151.07 26.95 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.94 149.16 44.62 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.622 1.569 . . . . 0.0 111.964 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -69.08 141.5 54.73 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.85 0.86 . . . . 0.0 110.438 162.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.51 -15.96 14.85 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -172.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.87 159.1 42.94 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.726 1.211 . . . . 0.0 113.158 -170.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.09 -163.57 52.4 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 124.364 0.983 . . . . 0.0 114.44 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.06 -24.35 73.15 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.545 2.83 . . . . 0.0 113.99 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.1 -6.82 59.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.706 1.603 . . . . 0.0 113.625 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.44 16.76 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.68 1.127 . . . . 0.0 111.967 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.36 -0.93 78.75 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 116.102 1.201 . . . . 0.0 116.102 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.59 153.21 41.52 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 119.127 1.464 . . . . 0.0 112.082 -174.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -55.09 143.49 73.74 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.435 3.423 . . . . 0.0 113.492 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.5 t -78.01 -37.8 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.983 -0.448 . . . . 0.0 111.358 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.9 t -139.06 166.1 25.39 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.367 1.467 . . . . 0.0 112.671 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -57.68 -29.44 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.094 -1.004 . . . . 0.0 112.896 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -62.38 -43.07 99.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.572 0.749 . . . . 0.0 111.941 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -64.68 -43.15 94.45 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.565 -0.71 . . . . 0.0 110.259 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.45 -46.83 88.43 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -57.12 -46.9 82.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.02 1.328 . . . . 0.0 111.417 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.4 t -72.69 -32.45 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 118.862 -0.59 . . . . 0.0 112.439 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.7 mt -65.33 -42.38 93.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.179 1.354 . . . . 0.0 111.291 171.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -40.36 88.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 118.732 0.696 . . . . 0.0 110.762 173.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -60.74 -52.04 66.79 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.776 0.716 . . . . 0.0 112.158 174.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -61.78 -39.96 93.51 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.532 0.605 . . . . 0.0 111.807 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -59.38 -54.51 45.89 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.915 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -51.62 -46.32 63.58 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.386 0.994 . . . . 0.0 111.458 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.37 -45.36 84.41 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.879 0.763 . . . . 0.0 111.953 -172.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -70.4 -42.52 71.55 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.37 -0.831 . . . . 0.0 111.927 178.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -58.48 -48.89 79.29 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 121.61 -0.681 . . . . 0.0 110.683 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -63.51 -40.01 95.92 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.516 1.527 . . . . 0.0 112.46 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -65.86 -29.91 70.44 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.865 0.757 . . . . 0.0 112.444 172.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.7 t -79.21 -37.53 37.94 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 171.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -149.04 105.67 3.38 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 127.892 2.477 . . . . 0.0 110.021 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.98 -11.63 25.58 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.648 3.566 . . . . 0.0 117.17 -157.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -69.1 -23.34 64.0 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -173.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 141.78 57.17 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -161.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -98.29 148.12 23.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.052 1.341 . . . . 0.0 111.983 172.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 tt -98.63 118.94 36.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.683 1.593 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -134.54 115.81 14.33 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 111.279 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.99 51.4 0.91 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.439 1.095 . . . . 0.0 113.406 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.4 t -63.89 155.54 30.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.709 160.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -56.98 -29.96 63.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.813 -1.179 . . . . 0.0 112.335 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -60.22 -41.85 93.97 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.424 -0.798 . . . . 0.0 112.53 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.29 86.98 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.679 0.792 . . . . 0.0 111.939 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.46 -48.1 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.514 175.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.88 -33.14 74.95 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.048 0.84 . . . . 0.0 112.288 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -69.3 -39.79 78.07 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.287 1.035 . . . . 0.0 113.002 174.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.0 -37.38 61.84 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -133.07 85.57 45.14 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 110.281 -168.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.84 -16.09 41.13 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.161 2.574 . . . . 0.0 114.619 -166.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 -75.2 -11.68 60.13 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 175.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.91 -26.93 49.36 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.095 0.861 . . . . 0.0 112.31 175.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 . . . . . 0 C--O 1.254 1.328 0 C-N-CA 128.272 2.629 . . . . 0.0 116.757 161.759 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.535 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.78 148.26 26.81 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.9 mt -123.75 151.08 43.64 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.86 1.664 . . . . 0.0 111.825 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -69.56 131.68 45.05 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.512 0.725 . . . . 0.0 109.88 161.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.43 -22.55 17.63 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -140.24 162.92 34.12 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.132 1.373 . . . . 0.0 112.647 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.14 -164.45 54.92 Favored Glycine 0 CA--C 1.542 1.771 0 C-N-CA 124.169 0.89 . . . . 0.0 114.463 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.67 -28.94 68.54 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 123.915 3.076 . . . . 0.0 114.646 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 79.9 mt -94.09 1.75 56.11 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.893 1.277 . . . . 0.0 113.542 -176.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.88 125.59 12.23 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.196 0.907 . . . . 0.0 112.268 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.95 -3.39 73.58 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 116.165 1.226 . . . . 0.0 116.165 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.2 mt -107.55 154.9 40.5 Favored Pre-proline 0 CA--C 1.551 1.006 0 CA-C-N 118.977 1.389 . . . . 0.0 112.566 -173.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -56.0 145.26 75.4 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.178 3.252 . . . . 0.0 113.008 176.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -79.18 -28.97 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.252 -0.28 . . . . 0.0 111.398 172.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.5 p -140.94 165.37 27.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.863 1.265 . . . . 0.0 112.262 -174.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -65.02 -27.08 68.56 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.172 -0.955 . . . . 0.0 112.694 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.3 t -69.07 -43.69 74.08 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.339 0.655 . . . . 0.0 111.444 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -61.96 -41.95 98.57 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.247 -0.908 . . . . 0.0 110.908 172.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.64 85.18 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.574 0.749 . . . . 0.0 112.693 176.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.5 -44.91 85.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.99 1.716 . . . . 0.0 111.757 174.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.26 -35.23 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.218 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.69 -45.27 93.56 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.605 1.548 . . . . 0.0 111.314 173.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.2 mt -62.52 -43.45 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 118.272 0.487 . . . . 0.0 110.471 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -59.73 -50.64 73.03 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.878 -0.514 . . . . 0.0 112.342 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -32.69 68.65 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.509 -0.744 . . . . 0.0 111.763 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.45 -48.88 73.63 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.611 0.765 . . . . 0.0 110.918 171.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.2 t90 -55.2 -44.69 75.57 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.788 170.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -65.8 -45.68 81.48 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 120.05 1.296 . . . . 0.0 112.093 -175.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.79 -46.57 88.99 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.945 -0.472 . . . . 0.0 111.695 174.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -58.05 -51.34 70.09 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.069 0.547 . . . . 0.0 111.156 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -53.7 -40.35 65.94 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.526 1.531 . . . . 0.0 111.968 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -68.53 -39.15 81.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.0 m -75.9 -29.36 58.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 175.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -154.2 105.02 2.42 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 128.732 2.813 . . . . 0.0 109.01 -162.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.67 -15.21 24.4 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.452 2.768 . . . . 0.0 116.164 -161.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -71.7 -25.29 62.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.7 tp -69.46 145.89 52.39 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -157.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -107.63 151.69 25.3 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.29 1.836 . . . . 0.0 111.994 172.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -105.11 119.49 39.17 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.678 1.591 . . . . 0.0 109.879 -176.297 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.79 120.47 18.35 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.609 1.163 . . . . 0.0 111.625 176.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.421 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.92 57.16 0.73 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.732 1.213 . . . . 0.0 112.639 -176.151 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 94.1 p -65.09 160.56 20.81 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.532 163.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -52.45 -39.21 60.8 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.203 -0.936 . . . . 0.0 111.279 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.1 -43.81 98.32 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.313 1.045 . . . . 0.0 112.546 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.76 85.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.665 1.121 . . . . 0.0 112.072 174.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.91 -47.12 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.117 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -68.04 -31.15 70.62 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.704 0.684 . . . . 0.0 112.639 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -71.22 -40.57 71.01 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.632 1.173 . . . . 0.0 112.964 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -73.42 -37.89 65.76 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.843 0.747 . . . . 0.0 112.937 174.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -130.72 85.34 55.99 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.853 1.661 . . . . 0.0 110.076 -168.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -70.41 -8.95 24.82 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.448 2.765 . . . . 0.0 114.852 -168.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -81.24 -9.31 59.8 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.67 -35.09 30.31 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.3 0.954 . . . . 0.0 113.223 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.315 0 CA-C-O 117.426 -1.273 . . . . 0.0 112.645 173.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.73 154.06 22.04 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.0 mt -125.77 148.81 48.98 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.442 1.497 . . . . 0.0 112.318 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -70.61 142.06 51.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.316 1.047 . . . . 0.0 110.503 163.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.91 -15.99 14.77 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -172.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.0 159.27 42.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.565 1.146 . . . . 0.0 113.07 -170.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.1 -162.91 52.75 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.385 0.993 . . . . 0.0 114.322 177.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.59 -24.18 74.15 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.46 2.773 . . . . 0.0 113.799 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.16 -6.22 59.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.655 1.582 . . . . 0.0 113.699 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.99 125.67 17.97 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.822 1.192 . . . . 0.0 111.99 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.68 -0.56 80.18 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 115.965 1.146 . . . . 0.0 115.965 -177.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.2 mt -106.78 153.38 40.79 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.1 1.45 . . . . 0.0 112.476 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -56.09 142.46 86.07 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.423 3.416 . . . . 0.0 113.07 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 t -77.82 -33.29 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.461 0.305 . . . . 0.0 110.937 173.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.18 164.72 26.72 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.787 1.235 . . . . 0.0 112.709 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.58 -29.19 70.48 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.119 -0.988 . . . . 0.0 112.53 173.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.8 m -68.36 -41.03 81.27 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.704 0.802 . . . . 0.0 111.292 173.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -61.68 -45.64 93.12 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.792 0.723 . . . . 0.0 110.588 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.41 86.28 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.262 0.625 . . . . 0.0 112.488 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -59.92 -42.18 93.37 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.425 1.49 . . . . 0.0 112.089 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.2 t -75.72 -33.12 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.385 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.63 -42.64 99.71 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.737 1.608 . . . . 0.0 111.331 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.5 mt -63.21 -42.78 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 122.991 0.517 . . . . 0.0 110.667 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -59.11 -47.03 86.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.659 0.663 . . . . 0.0 112.425 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -68.39 -37.46 80.39 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 111.998 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -63.17 -50.38 70.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.729 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -53.93 -43.61 69.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.765 1.166 . . . . 0.0 112.468 173.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -56.18 -50.62 70.67 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.971 1.26 . . . . 0.0 111.765 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.59 -48.03 73.7 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 178.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -56.07 -51.35 68.14 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.455 1.102 . . . . 0.0 110.632 176.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 91' ' ' LYS . 1.0 OUTLIER -56.41 -44.25 80.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.463 1.505 . . . . 0.0 111.883 176.23 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -61.91 -33.88 75.04 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.396 0.998 . . . . 0.0 112.848 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.9 m -78.68 -38.14 40.08 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -152.21 102.97 2.78 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 127.749 2.42 . . . . 0.0 109.659 -169.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.24 -14.08 25.66 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.966 3.111 . . . . 0.0 116.576 -160.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -65.83 -24.18 66.84 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.4 tp -64.62 145.03 56.77 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.78 0.718 . . . . 0.0 112.614 -165.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -102.34 150.28 23.49 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.955 1.302 . . . . 0.0 112.406 172.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.423 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.4 OUTLIER -102.38 115.94 31.6 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 109.497 -176.781 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.59 118.48 16.25 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.467 1.107 . . . . 0.0 111.842 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.423 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -156.12 54.41 0.57 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.592 1.157 . . . . 0.0 113.429 -173.054 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 t -75.07 163.35 27.67 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.594 0.758 . . . . 0.0 111.109 163.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -50.37 -39.45 46.63 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.688 1.195 . . . . 0.0 112.714 -177.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.55 -40.03 93.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.846 0.859 . . . . 0.0 112.719 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.99 88.5 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.517 0.727 . . . . 0.0 111.558 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.01 -46.64 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.346 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -68.0 -33.18 74.13 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.447 0.567 . . . . 0.0 112.342 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.9 ttt-85 -68.37 -41.17 80.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.594 0.758 . . . . 0.0 112.393 174.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.6 mtt-85 -73.44 -37.7 65.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.859 0.864 . . . . 0.0 112.785 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -134.55 88.0 30.33 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.976 1.71 . . . . 0.0 110.33 -170.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.22 -14.54 37.98 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.177 2.585 . . . . 0.0 114.672 -167.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -78.48 -6.87 56.6 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 177.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -86.1 -30.13 22.8 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 . . . . . 0 C--O 1.255 1.39 0 CA-C-N 119.342 0.974 . . . . 0.0 113.098 178.369 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.23 154.33 31.35 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.663 1.585 . . . . 0.0 113.88 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -121.81 149.58 43.13 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.457 1.503 . . . . 0.0 111.851 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -68.33 141.14 55.89 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.911 0.884 . . . . 0.0 110.487 162.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.14 -16.69 15.17 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.14 159.85 41.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.616 1.166 . . . . 0.0 112.862 -170.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.77 -164.39 53.23 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 124.248 0.928 . . . . 0.0 114.419 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.71 -24.05 74.09 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.489 2.793 . . . . 0.0 113.943 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.37 -6.14 59.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.749 1.62 . . . . 0.0 113.691 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.66 126.04 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.825 1.193 . . . . 0.0 112.037 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.22 -1.61 80.1 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 115.987 1.155 . . . . 0.0 115.987 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.8 mt -107.28 153.32 41.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 119.063 1.431 . . . . 0.0 112.238 -174.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -56.97 144.31 89.73 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 124.315 3.343 . . . . 0.0 113.043 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.7 t -78.61 -36.12 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.596 0.358 . . . . 0.0 111.493 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.5 t -140.98 166.12 25.66 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.402 1.481 . . . . 0.0 112.838 176.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -57.21 -28.96 63.32 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.409 1.484 . . . . 0.0 113.365 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.4 t -63.99 -42.07 97.32 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.371 0.668 . . . . 0.0 111.94 171.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -65.46 -45.04 85.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.173 -0.954 . . . . 0.0 110.326 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.9 89.15 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.639 0.654 . . . . 0.0 112.396 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -60.29 -47.7 84.89 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 0.0 111.676 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 74.1 t -69.35 -34.27 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.388 -0.82 . . . . 0.0 112.277 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.6 -43.65 93.11 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.505 1.502 . . . . 0.0 111.701 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.5 mt -68.0 -37.4 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 118.622 0.646 . . . . 0.0 110.893 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.93 -49.64 76.89 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.772 0.714 . . . . 0.0 111.993 171.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.78 -39.78 90.11 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.787 0.835 . . . . 0.0 111.788 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.49 -57.73 11.49 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.853 -1.07 . . . . 0.0 111.319 171.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 60.1 t90 -52.6 -46.75 67.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.127 1.33 . . . . 0.0 112.038 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -65.37 -43.32 91.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.035 0.934 . . . . 0.0 112.302 -174.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.43 -47.94 71.57 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.578 -0.701 . . . . 0.0 111.886 175.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -59.82 -44.79 93.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.57 0.748 . . . . 0.0 110.469 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.65 -35.75 80.63 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.983 1.313 . . . . 0.0 112.474 176.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -63.78 -39.08 93.4 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.341 0.973 . . . . 0.0 112.808 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -75.58 -36.27 60.39 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 175.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -149.92 103.4 3.2 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 127.637 2.375 . . . . 0.0 109.488 -170.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 -12.52 27.02 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.187 3.258 . . . . 0.0 116.632 -159.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.9 p-90 -68.93 -23.03 64.12 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.16 132.44 50.41 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -160.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -85.01 133.02 34.26 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.192 1.397 . . . . 0.0 110.601 170.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.8 tt -79.44 118.12 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.961 0.904 . . . . 0.0 108.72 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -122.07 115.38 22.38 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.49 0.716 . . . . 0.0 111.364 171.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.9 142.3 18.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.448 1.118 . . . . 0.0 112.968 164.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -152.1 171.62 17.6 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.766 2.827 . . . . 0.0 107.169 166.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -53.98 -34.1 58.86 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.612 -1.305 . . . . 0.0 112.96 -176.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.705 0.802 . . . . 0.0 112.848 171.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.5 87.74 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.851 0.861 . . . . 0.0 111.902 174.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.67 -44.93 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.132 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -67.92 -34.81 77.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.316 0.507 . . . . 0.0 112.069 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -65.18 -43.79 90.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.15 0.98 . . . . 0.0 112.176 175.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -74.79 -40.91 60.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.392 0.677 . . . . 0.0 112.328 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -125.99 90.28 50.6 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.859 1.664 . . . . 0.0 110.39 -172.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.04 -15.87 40.14 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.07 2.513 . . . . 0.0 114.696 -166.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -79.91 -6.89 58.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.51 -28.78 26.48 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--O 1.254 1.299 0 CA-C-N 119.202 0.91 . . . . 0.0 112.86 177.603 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.53 24.97 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 176.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.67 149.97 50.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.627 1.571 . . . . 0.0 111.815 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.77 129.62 40.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.908 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.44 -17.56 22.37 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -173.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.01 167.22 27.35 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.944 1.298 . . . . 0.0 112.942 -173.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.84 -165.95 54.74 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 124.032 0.825 . . . . 0.0 114.417 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -56.06 -28.41 69.47 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.982 3.121 . . . . 0.0 114.631 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.39 3.22 54.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 0.0 113.458 -176.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.3 125.83 11.76 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.141 0.882 . . . . 0.0 112.37 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.22 -3.27 76.1 Favored Glycine 0 CA--C 1.53 0.983 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -177.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 36.4 mt -106.14 155.27 38.8 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 119.01 1.405 . . . . 0.0 112.452 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -54.53 143.83 65.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.313 3.342 . . . . 0.0 112.585 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.8 t -78.15 -32.29 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 122.121 -0.362 . . . . 0.0 110.785 170.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -135.52 165.12 26.25 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.503 1.121 . . . . 0.0 113.422 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -58.75 -32.01 68.86 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.581 0.752 . . . . 0.0 112.821 171.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.5 m -71.17 -40.66 71.13 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.935 0.894 . . . . 0.0 111.704 174.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -62.07 -43.87 97.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.787 0.721 . . . . 0.0 110.561 172.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.83 -48.27 82.34 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.402 0.681 . . . . 0.0 111.991 177.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.4 ttm-85 -56.58 -46.07 80.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.856 1.262 . . . . 0.0 111.935 175.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 69.1 t -73.47 -34.15 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.08 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.85 -44.84 88.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 120.524 1.511 . . . . 0.0 111.427 173.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -62.18 -42.69 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.175 0.59 . . . . 0.0 110.338 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -60.93 -52.14 66.3 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -63.21 -39.6 95.09 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.332 0.653 . . . . 0.0 111.696 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.89 -52.84 63.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.144 0.578 . . . . 0.0 111.004 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -55.16 -41.53 71.96 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.18 0.9 . . . . 0.0 112.864 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -65.43 -45.03 85.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.687 1.131 . . . . 0.0 111.878 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -65.99 -43.9 86.42 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.304 -0.872 . . . . 0.0 112.336 175.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.98 -48.29 82.11 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.058 0.543 . . . . 0.0 110.491 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -59.14 -33.55 71.02 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.519 1.128 . . . . 0.0 112.166 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.67 -44.67 93.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.919 0.888 . . . . 0.0 112.985 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.1 p -86.02 -28.38 24.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -151.48 103.14 2.91 Favored Pre-proline 0 CA--C 1.557 1.226 0 C-N-CA 128.693 2.797 . . . . 0.0 109.832 -176.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.84 -13.74 24.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.94 3.093 . . . . 0.0 116.767 -160.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -67.28 -24.1 65.74 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -171.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.78 144.85 56.72 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -161.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -96.69 149.89 21.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.251 1.42 . . . . 0.0 113.167 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.19 118.4 36.44 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.785 1.634 . . . . 0.0 109.213 -178.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -131.53 110.61 11.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.235 1.014 . . . . 0.0 112.07 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.08 55.2 0.99 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.193 1.397 . . . . 0.0 112.674 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 92.5 p -62.14 154.96 25.65 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.169 156.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.05 -32.09 70.59 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.48 -1.387 . . . . 0.0 111.284 178.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -57.33 -43.73 83.61 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.578 1.151 . . . . 0.0 112.457 167.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.77 76.84 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.32 0.648 . . . . 0.0 112.652 174.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.28 -48.77 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 174.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.32 -29.53 69.12 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.437 0.562 . . . . 0.0 112.258 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -70.3 -45.19 66.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.602 1.161 . . . . 0.0 112.536 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -69.85 -37.41 76.14 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 118.658 0.663 . . . . 0.0 112.749 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -130.77 84.62 58.04 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.862 1.665 . . . . 0.0 110.475 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.25 -12.86 34.85 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.307 2.671 . . . . 0.0 114.571 -168.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -76.49 -11.56 59.9 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.21 -26.66 35.74 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 119.177 0.898 . . . . 0.0 112.818 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 128.03 2.532 . . . . 0.0 116.488 167.316 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.72 153.92 32.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.419 1.488 . . . . 0.0 114.122 171.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.42 149.88 43.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.633 1.573 . . . . 0.0 111.796 -178.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -69.05 141.43 54.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.897 0.879 . . . . 0.0 110.265 163.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.77 -17.71 15.46 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.33 160.22 40.33 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.645 1.178 . . . . 0.0 113.074 -170.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.04 -164.11 53.76 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 124.484 1.04 . . . . 0.0 114.45 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.79 -24.11 74.58 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.61 2.873 . . . . 0.0 113.812 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -6.17 59.35 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.759 1.624 . . . . 0.0 113.607 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.41 126.22 18.61 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.718 1.145 . . . . 0.0 112.23 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 -1.11 81.26 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -108.12 152.78 41.96 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-N 119.045 1.423 . . . . 0.0 112.363 -173.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.24 144.2 91.47 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 124.387 3.391 . . . . 0.0 113.23 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.8 t -80.48 -37.39 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 122.871 0.468 . . . . 0.0 111.537 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -139.05 168.92 18.76 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.356 1.462 . . . . 0.0 113.172 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -58.21 -35.06 71.09 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.753 1.221 . . . . 0.0 111.446 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -61.0 -39.95 91.66 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.264 1.026 . . . . 0.0 112.503 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -67.11 -47.01 72.42 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.534 -0.729 . . . . 0.0 110.005 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.19 -42.4 90.8 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.734 0.697 . . . . 0.0 112.524 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -58.96 -49.03 79.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.059 1.743 . . . . 0.0 111.703 172.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.11 -35.44 63.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-O 118.632 -0.699 . . . . 0.0 112.346 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.0 -48.64 79.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.069 1.304 . . . . 0.0 110.947 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.4 mt -63.01 -41.05 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.757 0.708 . . . . 0.0 110.94 176.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -55.14 37.74 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 122.957 0.503 . . . . 0.0 110.974 176.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -65.29 -36.03 82.83 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.828 -1.17 . . . . 0.0 112.682 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -56.85 -55.61 32.24 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.211 1.004 . . . . 0.0 110.935 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 56.3 t90 -51.85 -43.36 63.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.756 169.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -64.52 -46.93 80.8 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.731 1.15 . . . . 0.0 112.211 -173.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.03 -41.08 82.67 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.341 -0.849 . . . . 0.0 111.725 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.95 -50.46 73.98 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.581 -0.699 . . . . 0.0 111.098 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? -58.09 -39.9 79.76 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.607 1.963 . . . . 0.0 112.702 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -64.69 -35.79 82.17 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 118.899 0.772 . . . . 0.0 112.423 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.5 t -77.05 -37.57 54.41 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 174.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -150.52 106.98 3.11 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 128.127 2.571 . . . . 0.0 109.796 -172.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.55 -12.59 22.53 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.463 3.442 . . . . 0.0 116.919 -159.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -66.05 -25.02 66.85 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -174.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.1 tp -66.5 142.85 57.4 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -164.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -104.19 143.58 32.75 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.041 1.336 . . . . 0.0 111.949 175.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.42 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -93.64 119.84 33.15 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.226 1.41 . . . . 0.0 109.78 -178.561 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -135.1 120.62 19.27 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.551 1.141 . . . . 0.0 111.609 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.42 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.01 52.17 0.8 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.72 1.208 . . . . 0.0 112.876 -176.153 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.7 m -68.02 161.29 27.01 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.267 164.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -52.15 -38.52 57.84 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.991 -1.068 . . . . 0.0 113.075 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.73 -39.07 90.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.068 0.947 . . . . 0.0 112.787 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.1 -39.32 89.89 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.828 0.74 . . . . 0.0 111.485 174.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.26 -46.07 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.51 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.26 -30.09 67.05 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.479 0.581 . . . . 0.0 112.424 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -71.42 -40.24 70.56 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.748 0.819 . . . . 0.0 112.509 173.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 28.6 mmm-85 -68.93 -41.46 78.08 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.841 0.856 . . . . 0.0 112.127 173.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -136.38 90.57 17.48 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.576 1.55 . . . . 0.0 110.616 -168.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.13 -16.31 40.12 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.072 2.515 . . . . 0.0 114.795 -167.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -78.46 -6.51 55.54 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -85.95 -24.58 26.48 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 C--O 1.252 1.205 0 CA-C-N 119.76 1.164 . . . . 0.0 112.542 179.262 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.72 156.19 29.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.568 1.547 . . . . 0.0 114.262 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -128.81 149.87 50.55 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.579 1.552 . . . . 0.0 112.069 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -69.82 132.32 45.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.978 0.911 . . . . 0.0 109.977 163.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.12 -24.34 16.9 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -175.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.11 163.85 31.86 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.072 1.349 . . . . 0.0 112.519 -171.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.18 -166.21 54.77 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.08 0.847 . . . . 0.0 114.494 176.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.99 -28.7 70.3 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.043 3.162 . . . . 0.0 114.634 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.2 mt -94.93 2.8 55.44 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.981 1.312 . . . . 0.0 113.478 -176.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.77 126.68 14.41 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.198 0.908 . . . . 0.0 112.328 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.89 -3.4 77.48 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.5 mt -107.59 155.17 40.16 Favored Pre-proline 0 CA--C 1.552 1.042 0 CA-C-N 119.068 1.434 . . . . 0.0 112.599 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -55.34 144.07 73.59 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 124.333 3.355 . . . . 0.0 112.945 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.89 -32.95 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 122.147 -0.346 . . . . 0.0 110.848 172.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.0 p -133.37 164.11 27.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.899 1.28 . . . . 0.0 112.75 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -65.79 -25.78 67.4 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.912 -1.117 . . . . 0.0 112.843 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.8 t -68.27 -44.05 76.41 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.351 0.66 . . . . 0.0 111.098 170.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -59.17 -43.96 92.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.69 0.677 . . . . 0.0 110.643 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.63 84.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.495 0.718 . . . . 0.0 112.638 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -58.44 -43.82 88.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.127 0.971 . . . . 0.0 111.903 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.1 t -73.86 -31.9 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.523 179.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.7 mt -65.75 -42.57 90.75 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.659 1.572 . . . . 0.0 111.472 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -63.22 -41.79 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 118.52 0.6 . . . . 0.0 110.505 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -60.11 -50.16 74.78 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.76 -0.587 . . . . 0.0 112.312 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.83 -36.76 83.09 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 118.77 0.714 . . . . 0.0 111.952 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -59.51 -54.07 50.85 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.702 169.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -52.07 -43.65 63.95 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 119.218 0.917 . . . . 0.0 111.886 173.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.17 -48.67 79.02 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.834 0.853 . . . . 0.0 111.592 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.13 -44.59 79.45 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.539 -0.726 . . . . 0.0 112.335 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -57.33 -50.0 74.34 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.394 0.678 . . . . 0.0 110.363 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.52 -41.22 89.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.849 1.66 . . . . 0.0 112.333 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.12 -33.08 74.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.612 0.765 . . . . 0.0 112.529 174.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.5 m -82.19 -35.41 28.35 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -151.14 102.81 2.98 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 127.746 2.418 . . . . 0.0 109.732 -168.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.57 -12.8 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.241 3.294 . . . . 0.0 116.781 -158.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.2 p-90 -66.33 -25.4 66.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -172.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.0 tp -67.65 145.54 54.72 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -161.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -101.75 149.47 24.13 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.458 1.503 . . . . 0.0 112.47 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.87 116.31 32.42 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.793 1.637 . . . . 0.0 109.191 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.51 117.63 15.44 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.637 1.175 . . . . 0.0 111.309 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.59 51.19 0.76 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -66.94 159.58 28.15 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.235 0.614 . . . . 0.0 111.289 163.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -50.35 -38.37 41.81 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.809 1.244 . . . . 0.0 112.335 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -62.36 -39.26 92.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.121 0.969 . . . . 0.0 113.018 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.22 85.86 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.525 0.73 . . . . 0.0 111.611 173.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.65 -48.02 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.211 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -67.01 -31.07 71.38 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.8 0.727 . . . . 0.0 112.212 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -68.65 -42.24 78.24 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.134 0.974 . . . . 0.0 112.787 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -71.72 -42.83 66.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -130.68 81.24 68.1 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.04 1.736 . . . . 0.0 109.96 -163.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.14 -14.37 40.54 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.198 2.599 . . . . 0.0 114.528 -167.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 34.8 p-80 -74.95 -10.36 59.41 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.21 -26.87 28.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.471 1.032 . . . . 0.0 113.734 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.23 0 CA-C-N 119.231 0.923 . . . . 0.0 111.587 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.88 153.0 21.95 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -124.59 148.7 47.7 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.404 1.481 . . . . 0.0 112.021 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -69.88 141.6 53.14 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 110.327 162.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.62 -13.3 15.08 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -172.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.51 158.15 44.82 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.679 1.191 . . . . 0.0 112.893 -171.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.25 -163.0 51.45 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.431 1.015 . . . . 0.0 114.487 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.37 -24.09 73.04 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.522 2.814 . . . . 0.0 113.952 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.63 -7.13 59.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.647 1.579 . . . . 0.0 113.647 178.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.77 125.14 15.87 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.806 1.185 . . . . 0.0 112.027 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.2 -1.21 76.67 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 116.117 1.207 . . . . 0.0 116.117 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.0 mt -106.84 152.81 41.0 Favored Pre-proline 0 CA--C 1.549 0.938 0 CA-C-N 119.07 1.435 . . . . 0.0 112.452 -174.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -55.26 142.84 77.99 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 124.471 3.447 . . . . 0.0 112.866 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.3 t -78.02 -33.61 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.746 172.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.8 p -133.38 164.67 26.59 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.649 1.18 . . . . 0.0 113.185 -175.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -32.77 70.25 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.314 -0.866 . . . . 0.0 112.337 172.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -71.41 -38.7 71.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.929 0.892 . . . . 0.0 111.656 176.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -61.68 -45.22 94.92 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.826 0.739 . . . . 0.0 110.341 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.85 -46.84 89.0 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.223 0.609 . . . . 0.0 112.273 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -57.16 -44.8 83.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.145 1.378 . . . . 0.0 112.001 175.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.0 t -76.57 -32.34 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-O 118.563 -0.732 . . . . 0.0 112.29 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.8 mt -62.57 -44.16 97.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.417 1.462 . . . . 0.0 111.067 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.13 -40.8 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 118.658 0.663 . . . . 0.0 111.026 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -61.36 -48.64 80.36 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.68 -0.637 . . . . 0.0 112.314 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -65.17 -39.61 93.14 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.722 0.692 . . . . 0.0 111.909 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -55.87 -56.64 18.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.755 1.222 . . . . 0.0 110.667 173.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -51.44 -47.11 63.17 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 118.317 -0.849 . . . . 0.0 112.45 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.6 -47.82 79.88 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.879 1.218 . . . . 0.0 112.375 -173.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.0 -43.8 86.67 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.526 -0.734 . . . . 0.0 111.812 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -58.55 -52.96 63.42 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.844 -0.535 . . . . 0.0 110.998 175.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.3 tmtt? -54.73 -41.84 70.86 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.107 1.763 . . . . 0.0 112.613 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -67.6 -32.44 73.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.864 0.757 . . . . 0.0 112.806 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.3 t -78.07 -38.48 44.2 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 173.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -154.28 109.34 2.43 Favored Pre-proline 0 CA--C 1.554 1.108 0 C-N-CA 129.099 2.96 . . . . 0.0 109.482 -172.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.45 -13.72 22.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.182 3.255 . . . . 0.0 116.727 -160.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -67.43 -21.81 65.55 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.24 132.67 45.29 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.331 0.969 . . . . 0.0 110.81 -167.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -96.43 134.73 39.23 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.787 1.235 . . . . 0.0 112.413 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.411 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -83.16 119.14 24.15 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.88 1.272 . . . . 0.0 110.117 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -137.07 121.33 18.03 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.832 1.253 . . . . 0.0 111.579 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.411 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.2 55.55 0.76 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.638 1.175 . . . . 0.0 113.19 -177.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.9 t -63.82 153.27 37.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.464 158.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -54.9 -31.25 59.83 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.064 -1.022 . . . . 0.0 112.261 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.55 -41.5 94.64 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.871 0.869 . . . . 0.0 112.604 171.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.0 -37.64 88.34 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.776 0.83 . . . . 0.0 111.76 173.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -48.89 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.348 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -67.93 -30.46 69.78 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.688 0.677 . . . . 0.0 112.247 -178.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.56 -45.03 76.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.208 1.003 . . . . 0.0 112.379 172.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -71.81 -36.09 70.15 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.427 0.691 . . . . 0.0 112.771 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -133.02 84.74 47.89 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.919 1.688 . . . . 0.0 110.506 -169.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 -9.13 24.2 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.397 2.731 . . . . 0.0 114.979 -167.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 32.8 p-80 -81.44 -7.39 59.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.69 -36.97 28.1 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.273 0.942 . . . . 0.0 113.122 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.293 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.736 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -105.75 153.06 22.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.887 1.44 . . . . 0.0 114.887 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.9 mt -127.9 149.94 50.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.675 1.59 . . . . 0.0 111.977 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -70.19 131.04 43.63 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.602 0.761 . . . . 0.0 109.848 162.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.5 -25.18 17.71 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -175.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.36 164.55 29.95 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.307 1.443 . . . . 0.0 112.438 -171.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.29 -165.47 54.57 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.157 0.884 . . . . 0.0 114.542 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.33 -28.51 72.5 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 124.066 3.178 . . . . 0.0 114.648 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.0 mt -95.9 3.49 53.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.002 1.321 . . . . 0.0 113.519 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.37 126.03 12.3 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.098 0.863 . . . . 0.0 112.45 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.0 -2.96 76.58 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.79 1.186 . . . . 0.0 116.013 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.7 mt -107.49 154.66 40.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 CA-C-N 118.996 1.398 . . . . 0.0 112.657 -172.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -54.98 143.72 71.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.574 3.516 . . . . 0.0 112.925 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -79.05 -32.56 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.077 -0.389 . . . . 0.0 111.009 172.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -133.77 164.36 27.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.862 1.265 . . . . 0.0 112.491 -176.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.62 -26.58 68.46 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.914 -1.116 . . . . 0.0 112.808 172.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.2 t -68.19 -42.32 80.09 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.278 0.631 . . . . 0.0 111.169 171.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -61.25 -44.34 97.41 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.306 -0.871 . . . . 0.0 110.814 172.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.52 -47.16 87.39 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.371 0.668 . . . . 0.0 112.437 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.5 ttt-85 -58.09 -45.92 86.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.307 1.443 . . . . 0.0 111.833 175.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -74.2 -33.7 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.297 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.42 -46.34 88.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.235 1.38 . . . . 0.0 111.192 171.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 82.4 mt -61.55 -43.41 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.461 0.573 . . . . 0.0 110.798 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.62 -51.81 67.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.577 0.751 . . . . 0.0 112.267 177.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -69.09 -34.51 75.23 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.137 -0.977 . . . . 0.0 112.198 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -62.81 -50.87 69.29 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.374 0.67 . . . . 0.0 111.395 171.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 58.2 t90 -51.65 -44.58 63.05 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.043 0.838 . . . . 0.0 111.638 170.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.12 -46.38 87.55 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.396 0.998 . . . . 0.0 111.6 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -60.86 -47.99 83.85 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.566 0.747 . . . . 0.0 112.459 174.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -60.62 -51.34 69.83 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.573 -0.704 . . . . 0.0 111.201 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -62.32 -31.92 72.61 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.271 1.428 . . . . 0.0 112.914 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.5 tptt -60.96 -45.68 93.78 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.7 1.137 . . . . 0.0 112.345 165.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.1 t -77.7 -35.41 52.17 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -147.78 105.79 3.7 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 128.666 2.786 . . . . 0.0 108.946 -172.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.24 -14.28 25.66 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.901 3.067 . . . . 0.0 116.732 -157.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -68.47 -24.05 64.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -171.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.7 tp -68.66 140.4 55.46 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -98.13 153.95 18.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.92 1.288 . . . . 0.0 112.928 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -101.09 118.53 37.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.912 1.685 . . . . 0.0 109.329 178.539 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -135.93 119.44 16.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.492 1.117 . . . . 0.0 111.323 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' MET . . . . . 0.415 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.67 52.04 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.456 1.122 . . . . 0.0 113.377 -173.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.5 m -67.64 159.45 29.93 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.298 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -53.46 -37.0 62.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.094 -1.003 . . . . 0.0 112.596 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -61.86 -38.73 89.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.684 0.794 . . . . 0.0 113.06 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.59 91.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.994 0.815 . . . . 0.0 111.036 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.35 -47.69 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 119.177 -0.44 . . . . 0.0 110.464 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -67.97 -31.14 70.64 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.632 0.651 . . . . 0.0 112.568 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -70.12 -40.7 74.7 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.452 -0.78 . . . . 0.0 112.667 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -77.1 -33.49 56.93 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -133.41 83.65 48.93 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.923 1.689 . . . . 0.0 110.338 -171.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.43 -12.68 34.07 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.253 2.635 . . . . 0.0 114.563 -169.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -77.49 -7.19 55.84 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.74 -30.49 21.59 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.281 0.946 . . . . 0.0 113.41 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.227 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.0 ttm . . . . . 0 N--CA 1.495 1.816 0 CA-C-O 119.694 -0.194 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.71 138.06 21.81 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 125.088 1.355 . . . . 0.0 111.387 179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.64 137.11 2.15 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 124.903 1.239 . . . . 0.0 112.703 174.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -141.31 119.76 12.33 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.608 1.163 . . . . 0.0 111.839 -176.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -92.4 -23.77 19.08 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -174.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 t60 46.0 53.37 9.17 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 126.482 1.913 . . . . 0.0 114.517 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -67.91 123.96 22.04 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.386 -0.821 . . . . 0.0 111.85 -175.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -82.53 -11.46 58.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -166.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -83.18 107.56 15.82 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.354 0.979 . . . . 0.0 110.323 178.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.6 m-70 -104.29 -16.62 15.11 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.999 1.111 . . . . 0.0 113.999 -173.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.02 -141.85 23.81 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 125.054 1.311 . . . . 0.0 115.649 171.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.9 t -150.13 -57.83 0.18 Allowed 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.24 1.416 . . . . 0.0 110.727 170.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 75.23 3.35 69.77 Favored Glycine 0 CA--C 1.535 1.335 0 N-CA-C 116.276 1.27 . . . . 0.0 116.276 170.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -81.45 -12.91 58.75 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 118.989 1.394 . . . . 0.0 114.68 -172.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.01 -13.13 59.99 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.75 1.759 . . . . 0.0 115.75 -171.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.82 138.35 54.68 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.56 153.86 21.72 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.893 1.442 . . . . 0.0 114.893 -177.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.1 mt -125.62 149.31 48.52 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.405 1.482 . . . . 0.0 112.06 -178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.85 142.01 53.14 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.878 0.871 . . . . 0.0 110.557 164.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.88 -8.47 15.96 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.099 1.518 . . . . 0.0 115.099 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -147.14 161.85 40.04 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.29 1.036 . . . . 0.0 113.548 -173.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.05 -164.82 49.66 Favored Glycine 0 CA--C 1.542 1.75 0 C-N-CA 124.3 0.952 . . . . 0.0 114.378 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.78 -24.32 71.05 Favored 'Trans proline' 0 CA--C 1.539 0.751 0 C-N-CA 123.582 2.855 . . . . 0.0 113.85 179.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.43 -8.09 59.63 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.907 1.683 . . . . 0.0 113.861 178.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.47 125.67 16.99 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-N 119.654 1.116 . . . . 0.0 111.971 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.64 -1.25 78.43 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 116.189 1.236 . . . . 0.0 116.189 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.2 mt -107.37 153.9 40.95 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.02 1.41 . . . . 0.0 112.292 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -55.6 143.15 80.23 Favored 'Trans proline' 0 C--N 1.354 0.857 0 C-N-CA 124.231 3.287 . . . . 0.0 113.193 179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.4 t -79.45 -33.39 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 122.412 0.285 . . . . 0.0 111.002 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -133.31 165.36 25.0 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 42.3 mtt85 -52.78 -42.19 64.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.842 1.257 . . . . 0.0 111.397 170.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.4 m -71.52 -36.76 71.15 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.838 0.855 . . . . 0.0 113.116 177.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -61.62 -43.94 97.92 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.917 1.235 . . . . 0.0 110.502 171.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.42 -47.61 83.35 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.318 0.647 . . . . 0.0 112.447 178.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.5 ttm105 -55.18 -46.47 75.8 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.096 1.358 . . . . 0.0 111.845 174.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 94.0 t -77.29 -31.49 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 118.404 -0.808 . . . . 0.0 112.27 -177.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 48.1 mt -63.43 -43.57 97.05 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.491 1.496 . . . . 0.0 111.444 169.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.9 mt -63.43 -42.2 95.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 CA-C-N 118.257 0.48 . . . . 0.0 110.552 174.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -60.27 -49.23 78.43 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.539 0.609 . . . . 0.0 112.619 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 59.8 t-20 -60.83 -46.19 91.52 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 123.96 0.904 . . . . 0.0 110.676 -179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 57.3 tt0 -59.57 -52.19 66.61 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 118.349 -0.834 . . . . 0.0 111.633 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.431 ' CH2' ' HE2' ' A' ' 91' ' ' LYS . 66.1 t90 -52.99 -43.42 66.42 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 119.814 1.188 . . . . 0.0 112.359 175.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -68.21 -43.32 78.28 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.226 0.921 . . . . 0.0 111.835 -176.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -63.9 -46.62 84.03 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.337 -0.852 . . . . 0.0 112.079 174.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 -56.72 -48.29 78.07 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.521 0.728 . . . . 0.0 110.306 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.431 ' HE2' ' CH2' ' A' ' 87' ' ' TRP . 1.2 tmmt? -56.08 -39.42 72.07 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.493 1.517 . . . . 0.0 112.501 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.0 mtpt -66.03 -37.6 86.3 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 119.888 1.222 . . . . 0.0 112.728 172.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.3 m -74.57 -39.29 62.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -153.59 104.97 2.53 Favored Pre-proline 0 CA--C 1.555 1.148 0 C-N-CA 128.387 2.675 . . . . 0.0 109.297 -170.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -75.53 -14.21 20.1 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.613 2.875 . . . . 0.0 116.506 -160.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.3 p-90 -66.76 -22.43 66.04 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 -172.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -63.38 141.4 58.78 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.739 0.7 . . . . 0.0 112.428 -166.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -95.93 141.59 29.17 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.661 1.184 . . . . 0.0 111.536 174.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.405 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -91.44 117.48 29.73 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.752 1.221 . . . . 0.0 109.234 176.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -133.93 118.1 17.51 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.473 1.109 . . . . 0.0 111.559 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.405 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.58 57.13 0.81 Allowed 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 122.61 1.195 . . . . 0.0 112.454 -177.577 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 98.7 p -63.11 159.15 17.99 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.318 162.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -52.86 -39.9 62.96 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.133 -0.98 . . . . 0.0 111.381 175.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.97 -40.78 96.77 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.329 1.052 . . . . 0.0 112.77 173.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.66 -38.76 85.94 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.887 1.221 . . . . 0.0 111.935 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.04 -47.16 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 CA-C-O 118.854 -0.594 . . . . 0.0 110.257 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -71.73 -27.06 62.74 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 119.102 0.864 . . . . 0.0 112.959 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 -71.48 -40.0 70.54 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.396 1.078 . . . . 0.0 112.727 172.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -74.85 -38.44 61.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 174.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -132.86 80.8 59.96 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 125.959 1.704 . . . . 0.0 110.231 -168.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -68.37 -12.54 35.21 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.24 2.627 . . . . 0.0 114.746 -168.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -78.23 -8.65 58.6 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 176.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -78.02 -36.79 48.29 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 117.31 -1.329 . . . . 0.0 113.437 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 126.587 1.955 . . . . 0.0 115.084 170.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ttt . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 118.775 -0.631 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 ttm180 59.05 -172.36 0.11 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 125.928 1.691 . . . . 0.0 113.405 -176.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.33 -177.42 52.85 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 124.909 1.243 . . . . 0.0 114.931 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.7 m 55.9 34.66 24.0 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.091 1.756 . . . . 0.0 114.313 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.9 m80 -60.83 -34.89 75.24 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -172.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.9 t60 61.29 160.01 0.05 Allowed 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 126.819 2.048 . . . . 0.0 115.015 -171.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -147.78 145.93 28.98 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 124.968 1.307 . . . . 0.0 111.485 170.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -96.27 -86.14 0.32 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.428 1.091 . . . . 0.0 110.659 173.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -159.12 155.36 27.11 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.101 1.761 . . . . 0.0 110.419 178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -74.83 -154.83 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.399 1.48 . . . . 0.0 111.43 174.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -153.85 166.88 32.05 Favored Glycine 0 CA--C 1.536 1.363 0 O-C-N 120.712 -1.242 . . . . 0.0 113.872 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -143.46 162.07 36.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.918 1.687 . . . . 0.0 111.899 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 68.24 -147.61 47.72 Favored Glycine 0 CA--C 1.537 1.423 0 O-C-N 121.755 -0.591 . . . . 0.0 112.658 -172.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -69.09 143.58 54.16 Favored 'General case' 0 CA--C 1.545 0.784 0 O-C-N 121.976 -0.72 . . . . 0.0 112.512 176.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -80.83 178.35 8.45 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.778 1.231 . . . . 0.0 112.143 176.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.32 140.27 22.24 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -171.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.8 153.55 25.2 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.413 1.485 . . . . 0.0 113.916 174.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.3 mt -121.33 149.92 42.21 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.36 1.464 . . . . 0.0 111.512 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -67.66 140.33 56.81 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.335 0.654 . . . . 0.0 110.123 162.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.16 -17.28 15.43 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.26 159.92 41.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.661 1.184 . . . . 0.0 112.835 -170.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.82 -164.26 53.36 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 124.354 0.978 . . . . 0.0 114.51 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.94 -24.15 75.28 Favored 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.555 2.837 . . . . 0.0 113.949 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -83.89 -6.78 59.49 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.723 1.609 . . . . 0.0 113.553 178.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.43 125.54 16.53 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.774 1.17 . . . . 0.0 112.104 -178.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.88 -1.34 77.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 116.126 1.21 . . . . 0.0 116.126 -177.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.3 mt -107.34 152.82 41.39 Favored Pre-proline 0 CA--C 1.551 0.99 0 CA-C-N 119.116 1.458 . . . . 0.0 112.289 -174.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -58.19 144.33 95.59 Favored 'Trans proline' 0 C--N 1.353 0.808 0 C-N-CA 124.326 3.35 . . . . 0.0 112.874 -179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.0 t -79.48 -36.19 17.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 O-C-N 121.91 -0.493 . . . . 0.0 111.354 177.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -141.58 168.5 19.62 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.519 1.527 . . . . 0.0 112.874 177.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.9 -36.09 64.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.121 1.368 . . . . 0.0 111.99 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 32.9 m -60.31 -40.18 89.64 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.731 0.813 . . . . 0.0 112.262 174.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -68.17 -46.1 71.67 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.761 -0.587 . . . . 0.0 110.277 174.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.14 88.1 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.482 0.583 . . . . 0.0 112.106 178.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -62.69 -48.44 79.29 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.293 1.437 . . . . 0.0 111.466 177.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 57.2 t -70.28 -32.91 52.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-O 118.338 -0.839 . . . . 0.0 112.125 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.48 -46.03 88.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.434 1.47 . . . . 0.0 111.655 172.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -66.28 -38.11 81.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 CA-C-N 118.822 0.737 . . . . 0.0 110.9 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.4 t80 -61.37 -50.57 72.35 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.535 -0.728 . . . . 0.0 111.977 174.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -62.9 -36.99 85.16 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.213 0.605 . . . . 0.0 111.957 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -59.18 -57.23 13.97 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.869 0.868 . . . . 0.0 111.152 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 63.5 t90 -54.11 -46.08 72.03 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.041 0.837 . . . . 0.0 111.942 174.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.21 -46.64 79.86 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.66 0.664 . . . . 0.0 111.793 -173.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.15 -46.19 85.16 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.514 0.726 . . . . 0.0 111.615 176.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 3.5 mmp_? -58.81 -50.78 72.68 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 122.01 -0.431 . . . . 0.0 110.944 175.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -54.79 -40.61 69.62 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.025 1.33 . . . . 0.0 112.236 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -69.63 -31.46 69.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.942 0.897 . . . . 0.0 113.02 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.4 m -82.67 -31.47 28.66 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -149.11 104.28 3.35 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 127.779 2.432 . . . . 0.0 109.43 -169.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -76.47 4.42 5.51 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 124.878 3.719 . . . . 0.0 116.717 -157.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 23.9 p-90 -89.63 -23.38 21.93 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.6 tp -65.89 140.01 58.32 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -158.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -92.18 138.64 31.36 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.201 1.0 . . . . 0.0 111.606 172.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.1 tt -84.37 117.13 23.41 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.66 1.184 . . . . 0.0 108.274 175.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -123.59 112.42 17.42 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.777 0.831 . . . . 0.0 110.94 173.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -152.28 141.95 21.85 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.298 1.047 . . . . 0.0 112.49 164.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 34.3 t -157.79 170.1 23.12 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 128.993 2.917 . . . . 0.0 107.217 173.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -49.7 -39.28 36.39 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 121.12 -0.988 . . . . 0.0 112.592 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -61.39 -44.06 97.81 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.122 0.969 . . . . 0.0 112.1 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.51 -39.67 94.21 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.604 0.762 . . . . 0.0 112.028 176.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.29 -46.58 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 122.001 -0.437 . . . . 0.0 109.969 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.0 m-30 -71.24 -21.36 62.12 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 45.4 ttp180 -79.81 -42.78 23.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.872 1.269 . . . . 0.0 112.76 172.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.61 -42.37 82.53 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.664 0.665 . . . . 0.0 112.248 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -127.84 84.69 62.61 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 125.36 1.464 . . . . 0.0 109.952 -166.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -69.25 -11.1 30.7 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.298 2.666 . . . . 0.0 114.485 -167.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.2 p-80 -82.67 -7.4 59.65 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 175.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -82.08 -35.21 28.88 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.349 0.977 . . . . 0.0 112.641 178.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.0 ptt180 . . . . . 0 C--O 1.253 1.275 0 CA-C-O 117.792 -1.099 . . . . 0.0 113.086 168.722 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 tpt . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 119.033 -0.508 . . . . 0.0 112.158 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.4 ptt85 -143.05 168.7 19.1 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.977 1.311 . . . . 0.0 113.341 -172.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.47 63.0 2.19 Favored Glycine 0 CA--C 1.534 1.244 0 C-N-CA 124.583 1.087 . . . . 0.0 114.795 168.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 70.1 p -138.35 140.54 39.51 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.854 1.262 . . . . 0.0 112.717 173.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 72.0 t60 -158.87 139.44 12.54 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.553 1.541 . . . . 0.0 111.475 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -145.01 132.48 20.78 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.244 1.418 . . . . 0.0 110.924 174.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -155.58 147.77 23.61 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.828 1.251 . . . . 0.0 112.095 173.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 84.7 t60 -153.64 151.48 29.75 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.297 1.439 . . . . 0.0 111.427 167.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -145.8 136.71 24.52 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.63 1.172 . . . . 0.0 111.547 168.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -90.08 -67.37 0.85 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.792 0.837 . . . . 0.0 112.319 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 75.33 119.76 0.11 Allowed Glycine 0 CA--C 1.538 1.526 0 C-N-CA 125.101 1.334 . . . . 0.0 113.507 -174.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.9 t -157.85 162.32 38.37 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.622 1.169 . . . . 0.0 112.656 -178.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 78.06 6.11 87.32 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 116.819 1.488 . . . . 0.0 116.819 168.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -72.85 129.66 38.67 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 119.012 1.406 . . . . 0.0 112.268 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -145.12 146.83 31.97 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.943 1.697 . . . . 0.0 111.876 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -160.6 154.56 22.8 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.338 1.055 . . . . 0.0 112.121 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -116.81 150.73 37.86 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 176.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.5 mt -123.13 149.86 43.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.843 1.657 . . . . 0.0 112.176 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -70.34 141.56 52.26 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.109 0.964 . . . . 0.0 110.45 162.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.07 -17.1 15.07 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -172.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.99 159.98 40.85 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.58 1.152 . . . . 0.0 112.982 -170.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.46 -163.41 53.09 Favored Glycine 0 CA--C 1.542 1.755 0 C-N-CA 124.396 0.998 . . . . 0.0 114.397 177.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -59.73 -24.11 74.36 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.524 2.816 . . . . 0.0 113.86 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -5.98 59.34 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.659 1.583 . . . . 0.0 113.641 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.73 17.69 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.87 1.213 . . . . 0.0 112.148 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.75 -1.15 80.76 Favored Glycine 0 CA--C 1.53 0.994 0 N-CA-C 115.904 1.122 . . . . 0.0 115.904 -177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.4 mt -107.1 153.1 41.21 Favored Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.009 1.404 . . . . 0.0 112.221 -174.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -57.08 143.91 91.54 Favored 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 124.311 3.341 . . . . 0.0 113.123 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.4 t -78.13 -29.46 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.308 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -139.02 166.44 24.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.584 1.154 . . . . 0.0 112.86 -173.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 -59.42 -34.69 72.8 Favored 'General case' 0 N--CA 1.479 1.018 0 O-C-N 121.612 -0.68 . . . . 0.0 111.989 171.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 2.7 t -70.76 -39.47 73.23 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.06 0.544 . . . . 0.0 111.728 177.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -62.17 -44.66 96.11 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.367 -0.833 . . . . 0.0 110.722 171.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.26 -47.18 87.09 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.546 -0.721 . . . . 0.0 112.641 177.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.1 ttp85 -56.55 -47.12 80.14 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.643 . . . . 0.0 111.891 175.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 43.3 t -77.45 -30.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-O 118.342 -0.837 . . . . 0.0 112.613 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 67.1 mt -61.04 -44.64 97.11 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.721 1.601 . . . . 0.0 111.22 169.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 78.1 mt -63.53 -41.41 92.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 118.367 0.53 . . . . 0.0 110.952 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -60.29 -48.76 80.38 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 118.945 0.793 . . . . 0.0 112.288 174.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.2 t30 -64.71 -39.81 94.29 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 118.949 0.795 . . . . 0.0 111.989 -178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -58.68 -53.16 61.52 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.944 0.897 . . . . 0.0 111.146 171.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 76.9 t90 -55.56 -45.54 77.28 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-O 118.529 -0.748 . . . . 0.0 111.74 174.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.43 -48.72 79.88 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.514 1.052 . . . . 0.0 111.733 -175.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.29 -49.33 77.48 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.027 0.531 . . . . 0.0 111.654 175.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -59.21 -52.49 65.47 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 119.093 -0.479 . . . . 0.0 111.144 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -51.87 -44.1 63.55 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.163 1.785 . . . . 0.0 112.282 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -73.3 -26.06 60.91 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.0 m -85.95 -29.49 23.54 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 169.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -151.37 105.1 2.93 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 128.387 2.675 . . . . 0.0 109.433 -168.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.2 -11.6 23.1 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 124.169 3.246 . . . . 0.0 116.583 -160.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -68.2 -25.78 65.4 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -172.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.8 tp -70.82 144.82 50.67 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -158.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -105.6 143.56 33.59 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.928 1.691 . . . . 0.0 111.594 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -93.31 119.31 32.3 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.202 1.401 . . . . 0.0 109.73 -179.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -135.15 120.01 18.49 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.535 1.134 . . . . 0.0 111.672 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.421 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.67 50.13 0.75 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.786 1.234 . . . . 0.0 112.962 -176.649 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 36.0 m -66.96 161.5 24.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.683 0.793 . . . . 0.0 111.354 164.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -51.66 -39.57 58.42 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 121.179 -0.951 . . . . 0.0 112.99 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -60.7 -41.19 94.7 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.128 0.971 . . . . 0.0 112.729 173.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.07 -38.73 91.73 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 119.218 0.917 . . . . 0.0 111.715 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.81 -46.95 81.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 CA-C-O 119.168 -0.444 . . . . 0.0 110.289 177.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -69.98 -29.45 66.56 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -72.14 -40.23 68.2 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.162 0.985 . . . . 0.0 112.827 173.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -74.15 -41.56 61.33 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 118.805 0.729 . . . . 0.0 112.138 176.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -128.17 91.63 43.9 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 126.32 1.848 . . . . 0.0 110.282 -172.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -70.26 -14.98 35.1 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.182 2.588 . . . . 0.0 114.669 -167.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -81.23 -5.54 57.87 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -87.27 -29.04 21.95 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 . . . . . 0 C--O 1.256 1.403 0 CA-C-N 119.62 1.1 . . . . 0.0 112.881 178.327 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.498 1.975 0 N-CA-C 110.58 -0.156 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.1 ptt180 -150.04 162.59 40.09 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.938 1.295 . . . . 0.0 113.152 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -172.84 147.53 9.82 Favored Glycine 0 CA--C 1.535 1.321 0 C-N-CA 125.498 1.523 . . . . 0.0 112.371 174.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -152.95 174.13 14.51 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.68 1.192 . . . . 0.0 112.427 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 51.92 62.01 2.92 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.895 2.078 . . . . 0.0 113.109 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -117.11 101.57 8.58 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.876 1.271 . . . . 0.0 111.472 178.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -137.88 21.66 2.85 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.142 1.377 . . . . 0.0 113.242 -172.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -133.59 138.46 46.0 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.674 1.19 . . . . 0.0 112.066 -175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -156.18 166.02 34.69 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.031 1.332 . . . . 0.0 111.892 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 56.94 32.38 21.45 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.311 1.844 . . . . 0.0 115.279 168.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.82 -68.22 1.72 Allowed Glycine 0 CA--C 1.536 1.356 0 O-C-N 121.261 -0.899 . . . . 0.0 112.042 172.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.6 t 53.05 -159.57 0.13 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.669 1.588 . . . . 0.0 114.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 85.2 175.64 50.55 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 125.531 1.539 . . . . 0.0 115.336 177.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -143.73 47.29 1.46 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.603 1.561 . . . . 0.0 112.178 -173.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.0 tp -70.63 -33.26 70.81 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.947 1.299 . . . . 0.0 113.025 -172.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.41 143.54 42.68 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 113.345 0.869 . . . . 0.0 113.345 -177.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.56 152.11 22.8 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.34 150.66 46.97 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.737 1.615 . . . . 0.0 112.128 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -69.72 132.16 45.7 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 123.745 0.818 . . . . 0.0 109.981 162.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.74 -25.57 17.37 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.27 164.36 30.46 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.195 1.398 . . . . 0.0 112.392 -171.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.46 -166.16 54.62 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 124.292 0.948 . . . . 0.0 114.48 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -56.26 -28.64 72.53 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.033 3.156 . . . . 0.0 114.646 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.12 2.95 55.22 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.046 1.338 . . . . 0.0 113.511 -177.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.69 127.1 15.15 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 119.133 0.879 . . . . 0.0 112.323 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.45 -3.64 79.27 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 115.953 1.141 . . . . 0.0 115.953 -177.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 mt -107.37 155.04 40.22 Favored Pre-proline 0 CA--C 1.55 0.976 0 CA-C-N 118.966 1.383 . . . . 0.0 112.56 -172.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -57.19 144.41 90.63 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 124.278 3.319 . . . . 0.0 113.015 177.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 38.2 t -80.11 -28.81 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 122.376 0.27 . . . . 0.0 111.327 174.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.4 p -139.15 166.08 25.46 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.574 1.15 . . . . 0.0 112.88 -173.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 -60.79 -36.41 78.93 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.585 0.754 . . . . 0.0 111.429 173.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 21.9 t -65.21 -44.87 86.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.849 0.86 . . . . 0.0 111.36 174.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -60.89 -43.55 98.31 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.469 -0.769 . . . . 0.0 111.078 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.69 -48.34 81.21 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.47 -0.769 . . . . 0.0 112.634 177.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.5 ttt85 -61.16 -41.5 96.88 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.937 1.295 . . . . 0.0 111.893 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 76.7 t -74.31 -34.26 36.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-O 118.182 -0.914 . . . . 0.0 112.211 177.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 47.0 mt -61.31 -45.64 93.6 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.878 1.672 . . . . 0.0 111.355 171.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 64.7 mt -62.17 -43.87 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 CA-C-N 117.974 0.352 . . . . 0.0 110.47 175.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -58.62 -49.79 76.19 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.256 0.48 . . . . 0.0 112.12 175.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.31 -36.47 71.63 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 121.521 -0.737 . . . . 0.0 112.271 -174.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -60.84 -50.78 72.05 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 118.463 -0.78 . . . . 0.0 110.728 169.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.9 t90 -53.18 -43.7 67.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.419 1.009 . . . . 0.0 111.665 172.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -63.67 -45.04 91.93 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 120.076 1.307 . . . . 0.0 112.237 -176.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -65.1 -46.27 81.76 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.545 -0.722 . . . . 0.0 112.615 173.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.1 mmt180 -59.87 -48.09 83.09 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 121.592 -0.693 . . . . 0.0 110.493 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 tptt -57.34 -42.15 81.39 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.255 1.822 . . . . 0.0 111.986 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -59.55 -44.93 93.11 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.311 0.645 . . . . 0.0 112.451 170.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.7 m -77.09 -29.16 54.83 Favored 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -151.43 107.35 2.94 Favored Pre-proline 0 CA--C 1.552 1.049 0 C-N-CA 127.806 2.443 . . . . 0.0 109.312 -168.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -73.23 -14.48 25.67 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.826 3.017 . . . . 0.0 116.113 -160.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -70.96 -25.37 62.69 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -171.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -67.66 145.97 54.28 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -157.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -109.51 144.92 37.12 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.261 1.824 . . . . 0.0 111.5 173.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.46 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -98.18 122.2 41.04 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.85 1.66 . . . . 0.0 109.995 -177.199 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -137.59 120.35 16.31 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.658 1.183 . . . . 0.0 111.882 175.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.46 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.11 55.24 0.65 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.512 1.125 . . . . 0.0 113.385 -176.091 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.3 t -66.14 157.01 32.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.611 0.764 . . . . 0.0 110.913 161.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -54.26 -32.43 56.1 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.905 -1.122 . . . . 0.0 112.719 178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -61.23 -41.32 96.67 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.062 0.945 . . . . 0.0 112.579 171.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.01 -38.22 87.92 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.601 0.76 . . . . 0.0 111.73 174.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.71 -47.14 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-O 119.031 -0.509 . . . . 0.0 110.302 177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -67.76 -32.37 72.92 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 118.777 0.717 . . . . 0.0 112.385 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -69.02 -40.82 78.44 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 123.586 0.754 . . . . 0.0 112.625 174.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 78.6 mtt-85 -72.72 -39.32 67.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.965 0.906 . . . . 0.0 112.736 175.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -133.67 85.06 43.21 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 126.155 1.782 . . . . 0.0 109.979 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.97 -13.74 37.2 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.25 2.633 . . . . 0.0 114.611 -167.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -77.29 -8.86 58.32 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 114.209 1.188 . . . . 0.0 114.209 176.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -85.78 -29.59 23.71 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -178.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.9 ttp180 . . . . . 0 C--O 1.254 1.316 0 CA-C-N 119.42 1.009 . . . . 0.0 112.94 179.002 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.495 1.803 0 CA-C-O 120.348 0.118 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -142.1 161.2 38.59 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.551 1.54 . . . . 0.0 112.673 -178.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.03 158.96 23.92 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.992 1.758 . . . . 0.0 114.766 175.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 44.1 m -96.33 171.82 8.34 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.614 1.566 . . . . 0.0 112.627 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 -119.16 4.06 11.35 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 -62.62 -29.93 70.97 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -162.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -66.78 134.87 53.03 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.529 0.732 . . . . 0.0 112.401 -178.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -148.92 163.49 37.32 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.616 1.566 . . . . 0.0 111.897 178.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 14.8 t60 -153.88 154.08 33.23 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.619 1.168 . . . . 0.0 111.698 173.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -92.34 -31.58 15.3 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.277 1.031 . . . . 0.0 113.655 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -71.33 147.43 42.44 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 123.876 0.75 . . . . 0.0 113.899 -177.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.2 t -161.77 166.48 26.45 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 125.808 1.643 . . . . 0.0 111.286 177.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -175.3 159.22 27.21 Favored Glycine 0 CA--C 1.531 1.073 0 O-C-N 121.724 -0.61 . . . . 0.0 114.578 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -108.81 23.0 15.18 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.88 1.672 . . . . 0.0 113.46 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 pp -73.28 -11.02 60.35 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -171.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.41 140.56 58.88 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.201 1.0 . . . . 0.0 112.882 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -103.95 150.54 24.11 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.98 148.83 45.05 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.488 1.515 . . . . 0.0 112.02 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.62 142.05 53.56 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.057 0.943 . . . . 0.0 110.462 162.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.0 -15.57 15.07 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -172.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -137.95 158.64 43.92 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.462 1.105 . . . . 0.0 113.388 -169.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.79 -161.93 51.19 Favored Glycine 0 CA--C 1.542 1.724 0 C-N-CA 124.494 1.045 . . . . 0.0 114.411 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -59.16 -24.33 73.36 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.441 2.761 . . . . 0.0 113.91 179.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.78 -6.85 59.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.541 1.537 . . . . 0.0 113.523 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.98 125.09 16.05 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 120.007 1.276 . . . . 0.0 112.056 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.89 -0.5 79.47 Favored Glycine 0 CA--C 1.531 1.048 0 N-CA-C 116.121 1.208 . . . . 0.0 116.121 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 27.7 mt -106.56 152.96 40.86 Favored Pre-proline 0 CA--C 1.55 0.963 0 CA-C-N 118.924 1.362 . . . . 0.0 112.284 -174.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -56.97 143.42 92.44 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 124.505 3.47 . . . . 0.0 112.952 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 42.1 t -77.96 -39.33 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 O-C-N 121.899 -0.5 . . . . 0.0 111.452 176.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.1 t -134.67 164.15 28.17 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.254 1.422 . . . . 0.0 112.678 175.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -59.97 -27.23 66.66 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.003 -1.061 . . . . 0.0 112.833 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 62.5 m -68.86 -35.34 76.8 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 171.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -65.17 -44.56 88.08 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.257 0.935 . . . . 0.0 109.736 169.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.67 -44.99 93.37 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 177.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 -56.32 -48.54 76.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.822 1.649 . . . . 0.0 111.502 173.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 71.5 t -73.89 -33.45 37.0 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 CA-C-O 118.546 -0.74 . . . . 0.0 112.186 -178.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 66.0 mt -62.13 -47.97 82.2 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 120.262 1.392 . . . . 0.0 111.1 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.9 mt -61.77 -43.37 97.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 122.885 0.474 . . . . 0.0 110.789 175.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -59.5 -52.47 65.42 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.747 0.819 . . . . 0.0 112.41 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -68.56 -34.65 76.2 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 121.678 -0.639 . . . . 0.0 112.337 -178.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -61.47 -53.21 59.39 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.14 170.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -52.17 -45.74 65.23 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 118.361 -0.828 . . . . 0.0 111.359 172.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.3 tm-20 -64.87 -42.1 95.13 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 119.646 1.112 . . . . 0.0 112.679 -175.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -62.97 -47.98 80.84 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 118.896 0.771 . . . . 0.0 111.506 173.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 14.0 mmp_? -59.66 -50.84 72.3 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 121.715 -0.616 . . . . 0.0 110.918 177.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -52.46 -41.34 63.23 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.596 1.959 . . . . 0.0 112.6 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -67.59 -36.73 81.44 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.491 1.116 . . . . 0.0 111.874 175.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 5.4 t -79.49 -33.23 42.36 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 114.444 1.276 . . . . 0.0 114.444 176.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -152.98 112.14 2.69 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 128.427 2.691 . . . . 0.0 109.669 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.94 -11.64 18.0 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 124.34 3.36 . . . . 0.0 116.401 -161.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.6 p-90 -66.74 -24.84 66.28 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 -172.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.7 tp -71.91 144.16 49.07 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.82 1.044 . . . . 0.0 113.82 -159.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 89.4 mtm-85 -103.04 147.94 26.33 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.048 1.739 . . . . 0.0 112.174 171.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.417 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -98.97 118.24 35.29 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.543 1.537 . . . . 0.0 109.26 -179.709 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -134.34 115.35 13.96 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.38 1.072 . . . . 0.0 111.922 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.417 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.13 49.43 0.78 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.84 1.256 . . . . 0.0 112.997 -175.369 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 43.1 t -64.21 156.31 29.11 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.809 162.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -50.28 -36.89 33.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.447 1.099 . . . . 0.0 112.029 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -61.74 -42.45 98.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.137 0.975 . . . . 0.0 112.251 174.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.04 89.63 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 118.695 0.679 . . . . 0.0 111.49 174.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.4 -45.74 85.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 O-C-N 121.996 -0.44 . . . . 0.0 110.342 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -68.01 -31.49 71.21 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -72.1 -40.26 68.31 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.281 1.032 . . . . 0.0 112.835 174.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 92.8 mtt-85 -74.31 -37.28 63.67 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.754 0.822 . . . . 0.0 112.802 176.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -132.95 88.59 36.71 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 125.857 1.663 . . . . 0.0 110.205 -170.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -70.21 -10.56 28.48 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.329 2.686 . . . . 0.0 114.819 -166.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.5 p-80 -82.81 -6.61 59.51 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 176.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.64 -32.45 23.66 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.365 0.984 . . . . 0.0 113.217 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 . . . . . 0 C--O 1.256 1.395 0 C-N-CA 123.839 0.856 . . . . 0.0 113.127 169.54 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.495 1.823 0 CA-C-O 120.044 -0.027 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -70.5 157.44 37.86 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.402 1.081 . . . . 0.0 112.586 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 84.88 109.05 0.65 Allowed Glycine 0 CA--C 1.536 1.374 0 C-N-CA 125.501 1.524 . . . . 0.0 112.634 -178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 t -86.2 -28.29 23.98 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.007 0.923 . . . . 0.0 113.372 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.7 166.95 21.82 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -73.33 129.88 38.97 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.579 0.751 . . . . 0.0 112.023 174.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -89.35 89.64 7.97 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.601 1.16 . . . . 0.0 109.907 172.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 53.34 37.92 26.57 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.552 1.541 . . . . 0.0 113.662 -175.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 63.76 117.06 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 128.318 2.647 . . . . 0.0 114.362 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.2 m170 -74.14 -22.35 59.49 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -172.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.65 -160.99 53.91 Favored Glycine 0 CA--C 1.538 1.473 0 CA-C-N 118.902 0.774 . . . . 0.0 113.898 -170.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 91.6 p -143.67 163.03 34.41 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.322 1.449 . . . . 0.0 112.454 173.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -79.03 -163.32 25.03 Favored Glycine 0 CA--C 1.537 1.407 0 C-N-CA 124.704 1.145 . . . . 0.0 114.625 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -76.38 51.9 0.74 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 125.855 1.662 . . . . 0.0 113.226 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 45.7 tp -75.21 -30.13 60.53 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 126.056 1.742 . . . . 0.0 112.383 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.36 142.3 50.38 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.636 -0.665 . . . . 0.0 112.693 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.49 152.63 23.41 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 114.826 1.417 . . . . 0.0 114.826 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.7 mt -124.14 150.43 45.12 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.582 1.553 . . . . 0.0 111.83 -177.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -68.34 131.66 45.71 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.543 0.737 . . . . 0.0 110.182 164.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.3 -18.4 22.49 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.49 167.49 27.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.972 1.309 . . . . 0.0 112.904 -173.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.62 -168.86 54.81 Favored Glycine 0 CA--C 1.542 1.73 0 C-N-CA 124.105 0.86 . . . . 0.0 114.571 178.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.6 -28.51 75.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.166 3.244 . . . . 0.0 114.542 -174.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 93.3 mt -95.47 3.76 53.93 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.996 1.318 . . . . 0.0 113.507 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.29 128.94 17.79 Favored 'General case' 0 CA--C 1.546 0.819 0 CA-C-N 118.941 0.791 . . . . 0.0 112.489 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.59 -5.25 82.46 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 115.948 1.139 . . . . 0.0 115.948 -176.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 40.5 mt -106.82 155.97 38.11 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 118.919 1.359 . . . . 0.0 112.166 -173.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -56.89 142.31 93.04 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 124.099 3.199 . . . . 0.0 112.88 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -78.35 -32.05 16.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 CA-C-O 119.532 -0.271 . . . . 0.0 110.91 174.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -134.23 166.52 22.59 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.468 1.107 . . . . 0.0 113.304 -175.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -62.74 -36.24 82.39 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 121.436 -0.79 . . . . 0.0 111.269 173.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.1 m -65.23 -41.34 94.47 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.064 0.946 . . . . 0.0 111.823 173.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -60.54 -46.0 91.79 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 118.878 0.763 . . . . 0.0 110.452 172.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.58 -46.1 91.5 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.3 mmm180 -57.35 -46.55 83.19 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.711 1.204 . . . . 0.0 111.218 174.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.5 t -73.15 -32.45 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.825 0 C-N-CA 123.717 0.807 . . . . 0.0 112.428 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 75.4 mt -62.15 -47.19 85.64 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 120.27 1.395 . . . . 0.0 110.955 170.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.4 mt -63.05 -41.24 92.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-N 118.833 0.742 . . . . 0.0 110.675 176.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -59.85 -51.22 70.66 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 175.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -66.85 -39.76 87.69 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.698 -0.626 . . . . 0.0 111.521 -178.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -56.99 -52.74 64.04 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.821 0.848 . . . . 0.0 111.201 172.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 61.1 t90 -52.52 -45.24 66.2 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 118.298 -0.858 . . . . 0.0 112.12 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -68.88 -40.67 79.09 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.717 1.144 . . . . 0.0 112.8 -174.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -63.72 -45.47 89.8 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.212 -0.93 . . . . 0.0 112.004 172.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 34.2 mmt180 -58.37 -52.1 67.03 Favored 'General case' 0 N--CA 1.473 0.706 0 O-C-N 121.763 -0.586 . . . . 0.0 110.653 174.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -50.46 -40.61 51.26 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 126.432 1.893 . . . . 0.0 112.509 173.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -69.63 -34.23 73.75 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.076 0.95 . . . . 0.0 111.771 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.0 t -78.44 -37.89 42.58 Favored 'General case' 0 N--CA 1.478 0.948 0 N-CA-C 114.123 1.157 . . . . 0.0 114.123 173.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -153.47 108.73 2.58 Favored Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.797 2.839 . . . . 0.0 109.584 -171.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.43 -13.87 18.35 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 124.007 3.138 . . . . 0.0 116.656 -160.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.9 p-90 -65.09 -25.33 67.75 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 115.294 1.591 . . . . 0.0 115.294 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 34.0 tp -65.61 142.89 57.91 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -162.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 68.7 mtp85 -87.04 148.06 25.44 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 124.505 1.122 . . . . 0.0 113.163 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.31 108.25 19.83 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.852 1.261 . . . . 0.0 108.754 167.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -132.31 122.92 25.88 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.819 1.248 . . . . 0.0 110.005 173.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.83 64.21 0.79 Allowed 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -175.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -65.63 162.87 17.44 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.076 0.95 . . . . 0.0 112.155 166.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -53.96 -36.5 62.93 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 120.849 -1.157 . . . . 0.0 111.784 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -62.77 -40.97 98.96 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.974 0.91 . . . . 0.0 112.402 172.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.27 91.27 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.639 1.109 . . . . 0.0 112.059 172.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -47.3 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 118.919 -0.562 . . . . 0.0 110.143 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -69.15 -30.93 69.27 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.018 0.826 . . . . 0.0 112.491 -179.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -70.33 -37.77 74.76 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.296 1.038 . . . . 0.0 112.943 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -72.9 -42.73 63.27 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-N 119.042 0.837 . . . . 0.0 112.816 169.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -132.33 84.16 52.82 Favored Pre-proline 0 CA--C 1.548 0.879 0 C-N-CA 125.814 1.646 . . . . 0.0 110.131 -163.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.6 -14.95 40.68 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.245 2.63 . . . . 0.0 114.506 -166.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -77.17 -8.28 57.27 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -88.84 -21.43 23.71 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 . . . . . 0 C--O 1.253 1.282 0 CA-C-N 119.871 1.214 . . . . 0.0 112.451 175.692 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.498 1.933 0 CA-C-O 119.99 -0.053 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 51.19 50.56 18.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 126.151 1.78 . . . . 0.0 113.917 175.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -162.28 -159.77 10.53 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 125.079 1.323 . . . . 0.0 113.604 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 t 58.92 -165.89 0.18 Allowed 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.597 1.559 . . . . 0.0 113.737 -174.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 55.83 43.7 27.21 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.532 1.933 . . . . 0.0 113.384 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 -80.67 144.49 32.23 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.479 1.112 . . . . 0.0 111.874 174.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -137.97 156.47 47.82 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.482 1.513 . . . . 0.0 111.877 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -107.99 127.78 54.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.672 1.189 . . . . 0.0 111.422 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 63.2 m80 -94.62 9.15 39.86 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -169.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -66.64 147.64 52.99 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 169.04 179.74 41.26 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.939 1.733 . . . . 0.0 112.132 -176.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.0 p -153.97 150.51 28.39 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.944 1.09 . . . . 0.0 113.944 178.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -73.34 140.42 28.35 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.063 0.84 . . . . 0.0 113.27 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -153.26 167.26 29.92 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.676 1.59 . . . . 0.0 111.83 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 pp -130.43 149.8 51.94 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.259 1.424 . . . . 0.0 114.303 -174.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -153.71 151.81 30.06 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.7 1.2 . . . . 0.0 112.384 177.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.48 154.47 32.46 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 114.538 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.3 mt -126.05 149.13 49.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 112.085 -177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -70.64 142.38 51.63 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.025 0.93 . . . . 0.0 110.485 162.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.67 -14.14 14.88 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -172.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.55 158.23 44.64 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.596 1.159 . . . . 0.0 113.034 -171.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.38 -162.86 51.72 Favored Glycine 0 CA--C 1.54 1.638 0 C-N-CA 124.373 0.987 . . . . 0.0 114.442 177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -59.3 -24.42 74.21 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.627 2.885 . . . . 0.0 113.871 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.0 mp -83.25 -7.38 59.61 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.638 1.575 . . . . 0.0 113.68 178.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.41 16.88 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.796 1.18 . . . . 0.0 112.061 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.14 -0.76 79.1 Favored Glycine 0 CA--C 1.53 1.01 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -177.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.11 153.55 40.95 Favored Pre-proline 0 CA--C 1.552 1.038 0 CA-C-N 119.002 1.401 . . . . 0.0 112.144 -174.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -56.16 142.84 86.28 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 124.327 3.351 . . . . 0.0 113.071 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.2 t -77.32 -33.76 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.746 172.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.9 p -133.84 164.45 27.22 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.614 1.166 . . . . 0.0 113.274 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -60.57 -31.28 70.41 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.332 -0.855 . . . . 0.0 112.685 172.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.6 m -69.42 -41.42 76.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.851 0.86 . . . . 0.0 111.66 173.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -61.25 -45.05 96.14 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.708 0.685 . . . . 0.0 110.463 172.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.62 85.34 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.507 0.723 . . . . 0.0 112.251 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.8 ttt-85 -56.64 -45.62 81.49 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.885 1.274 . . . . 0.0 111.797 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.33 -33.87 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-O 118.549 -0.739 . . . . 0.0 112.532 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 50.0 mt -62.85 -44.08 97.08 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 120.409 1.458 . . . . 0.0 111.193 172.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.43 -42.49 95.83 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-N 118.528 0.603 . . . . 0.0 110.8 174.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -60.57 -50.15 74.67 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.79 -0.569 . . . . 0.0 112.286 176.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -69.09 -35.1 76.1 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.571 -0.706 . . . . 0.0 112.234 -177.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.55 -56.24 23.82 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.262 1.025 . . . . 0.0 110.541 169.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 72.1 t90 -52.87 -45.61 67.51 Favored 'General case' 0 C--N 1.342 0.263 0 CA-C-O 118.597 -0.716 . . . . 0.0 111.911 173.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -67.42 -41.75 84.31 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.344 0.975 . . . . 0.0 112.238 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -67.49 -43.98 79.64 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.214 -0.929 . . . . 0.0 111.611 176.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -57.6 -49.56 76.01 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 121.654 -0.654 . . . . 0.0 110.759 172.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -54.96 -43.05 73.11 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 126.396 1.878 . . . . 0.0 112.453 175.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -63.33 -36.99 85.53 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.675 0.79 . . . . 0.0 112.146 175.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.6 m -77.64 -36.71 51.22 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -152.93 103.99 2.65 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 128.094 2.558 . . . . 0.0 109.788 -168.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.67 -13.32 22.24 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 124.095 3.197 . . . . 0.0 116.679 -160.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -65.5 -24.2 67.08 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 115.447 1.647 . . . . 0.0 115.447 -172.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.64 146.61 54.6 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -163.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.7 ptp180 -100.42 150.95 22.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.252 1.421 . . . . 0.0 113.232 173.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.409 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.6 OUTLIER -109.37 117.87 35.17 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.791 1.636 . . . . 0.0 109.535 -177.451 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.29 120.48 18.9 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.555 1.142 . . . . 0.0 111.613 176.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.409 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -151.51 53.08 0.83 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.589 1.156 . . . . 0.0 113.043 -176.128 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 39.8 t -67.8 157.09 35.57 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.785 160.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -54.3 -31.6 54.44 Favored 'General case' 0 N--CA 1.472 0.659 0 O-C-N 120.853 -1.154 . . . . 0.0 112.781 179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? -61.52 -41.54 97.48 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.815 0.846 . . . . 0.0 112.036 172.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.95 -38.73 89.36 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.798 0.839 . . . . 0.0 111.849 173.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.61 -47.44 83.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.318 178.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -67.92 -32.59 73.15 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 118.624 0.647 . . . . 0.0 112.264 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 73.2 ttt-85 -69.8 -39.24 76.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.626 -0.672 . . . . 0.0 112.601 176.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 41.9 mtt180 -71.82 -41.95 67.61 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-N 118.694 0.679 . . . . 0.0 112.649 172.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 32.5 m-85 -130.77 83.31 61.95 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.701 1.601 . . . . 0.0 110.133 -165.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.35 -14.66 40.73 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 123.299 2.666 . . . . 0.0 114.599 -166.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.7 p-80 -77.49 -8.32 57.6 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.045 1.128 . . . . 0.0 114.045 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.52 -29.56 25.85 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.489 1.04 . . . . 0.0 113.593 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? . . . . . 0 C--O 1.256 1.416 0 C-N-CA 124.066 0.947 . . . . 0.0 112.741 177.509 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 tmt? . . . . . 0 N--CA 1.496 1.834 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -146.59 150.19 35.02 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.471 1.508 . . . . 0.0 111.444 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.66 -175.43 54.91 Favored Glycine 0 CA--C 1.536 1.351 0 C-N-CA 124.624 1.106 . . . . 0.0 114.539 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.4 t -150.58 49.9 0.88 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.836 1.654 . . . . 0.0 110.212 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -119.36 32.71 5.96 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.663 1.585 . . . . 0.0 112.95 -163.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -125.77 155.48 40.97 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 126.13 1.772 . . . . 0.0 112.11 -177.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -142.5 145.71 33.97 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.317 1.447 . . . . 0.0 112.109 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -149.32 147.09 27.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.434 1.493 . . . . 0.0 111.491 177.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -147.17 150.66 35.37 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.962 1.305 . . . . 0.0 112.131 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.497 ' CG ' ' H ' ' A' ' 11' ' ' GLY . 18.9 t-80 52.57 -154.2 0.21 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.135 1.774 . . . . 0.0 112.918 -179.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.497 ' H ' ' CG ' ' A' ' 10' ' ' HIS . . . 176.27 166.03 32.91 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.662 -1.274 . . . . 0.0 114.54 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 m -64.89 141.46 58.77 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.471 1.109 . . . . 0.0 112.976 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.38 26.48 0.21 Allowed Glycine 0 CA--C 1.535 1.334 0 N-CA-C 115.187 0.835 . . . . 0.0 115.187 -177.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.48 102.46 6.91 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.271 1.036 . . . . 0.0 111.489 -177.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 pp -81.39 -12.34 58.99 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.92 148.64 49.03 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.411 1.085 . . . . 0.0 113.186 178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -100.4 140.84 34.08 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 174.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.48 152.06 50.14 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 125.614 1.566 . . . . 0.0 112.219 -179.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -68.11 145.39 54.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.455 1.502 . . . . 0.0 111.343 175.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.2 -13.79 14.84 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 115.048 1.499 . . . . 0.0 115.048 -174.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -138.76 158.96 43.26 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.568 1.147 . . . . 0.0 112.93 -171.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.19 -164.09 52.3 Favored Glycine 0 CA--C 1.541 1.659 0 C-N-CA 124.396 0.998 . . . . 0.0 114.436 177.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.98 -23.79 74.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.404 2.736 . . . . 0.0 113.844 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mp -84.27 -5.66 59.29 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.532 1.533 . . . . 0.0 113.76 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.91 127.28 23.13 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 119.992 1.269 . . . . 0.0 112.147 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.28 -7.67 80.2 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 124.724 1.154 . . . . 0.0 115.698 -176.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.7 mt -104.43 149.65 37.61 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 118.893 1.347 . . . . 0.0 112.058 -170.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -58.76 146.43 92.59 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 124.371 3.381 . . . . 0.0 113.019 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -77.85 -28.63 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.397 175.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 1.8 p -140.3 167.2 22.69 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.468 1.107 . . . . 0.0 112.823 -172.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -65.61 -33.94 77.07 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.854 0.862 . . . . 0.0 111.772 176.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 9.8 t -69.05 -42.03 76.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.561 0.744 . . . . 0.0 111.83 173.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -64.6 -38.46 91.07 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.502 -0.749 . . . . 0.0 111.466 174.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.65 -46.37 90.05 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 121.45 -0.781 . . . . 0.0 112.419 173.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 6.0 tmm_? -56.1 -44.49 79.11 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.232 1.413 . . . . 0.0 112.016 171.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.03 -35.44 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 CA-C-O 118.4 -0.809 . . . . 0.0 112.149 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.9 mt -62.33 -44.18 97.08 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 120.616 1.553 . . . . 0.0 111.361 172.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.76 -40.94 90.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 CA-C-N 118.286 0.494 . . . . 0.0 110.863 174.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.94 -46.69 88.22 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.563 -0.711 . . . . 0.0 112.578 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.17 -38.37 90.34 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.496 0.719 . . . . 0.0 111.632 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -59.65 -55.85 29.3 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 118.588 -0.72 . . . . 0.0 111.005 169.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 84.9 t90 -54.14 -42.11 69.18 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.605 1.093 . . . . 0.0 112.692 177.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -59.96 -49.44 77.69 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.767 1.167 . . . . 0.0 112.649 175.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -59.92 -49.61 77.03 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.276 -0.89 . . . . 0.0 111.489 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 38.8 mmt-85 -61.22 -49.37 77.4 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.984 0.913 . . . . 0.0 110.372 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.36 -38.12 79.62 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.188 1.395 . . . . 0.0 112.565 178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 30.3 mttm -66.12 -37.49 85.85 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 119.088 0.858 . . . . 0.0 112.311 173.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.1 m -76.81 -36.78 56.69 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 114.622 1.342 . . . . 0.0 114.622 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -153.49 104.38 2.55 Favored Pre-proline 0 CA--C 1.554 1.103 0 C-N-CA 128.174 2.59 . . . . 0.0 109.617 -168.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.88 -13.01 24.16 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 124.041 3.16 . . . . 0.0 116.65 -160.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -67.94 -24.12 65.14 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -171.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.5 tp -65.25 143.1 58.03 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -161.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -93.37 147.37 22.99 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.901 1.28 . . . . 0.0 111.862 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.82 118.03 36.08 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.497 1.519 . . . . 0.0 109.276 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.6 115.53 14.79 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.404 1.082 . . . . 0.0 111.721 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.68 49.43 0.87 Allowed 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.809 1.244 . . . . 0.0 112.973 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.3 t -64.6 157.08 27.98 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.72 160.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -51.7 -38.97 57.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.212 1.005 . . . . 0.0 112.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -62.65 -37.04 84.8 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.854 0.862 . . . . 0.0 113.091 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.28 87.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 118.933 0.788 . . . . 0.0 111.417 173.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.53 -47.61 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-O 118.964 -0.541 . . . . 0.0 110.151 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -69.31 -29.56 67.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 118.846 0.748 . . . . 0.0 112.269 -178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -74.4 -36.14 63.47 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 175.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 13.2 ttm180 -78.25 -39.7 39.44 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 119.266 0.939 . . . . 0.0 111.967 174.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -127.36 90.29 49.18 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 126.313 1.845 . . . . 0.0 110.329 -172.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -71.28 -12.68 30.21 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.204 2.603 . . . . 0.0 115.086 -165.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -82.68 -5.07 58.66 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.77 -19.68 28.72 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -176.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.169 0 CA-C-N 119.904 1.229 . . . . 0.0 111.167 165.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mmt . . . . . 0 N--CA 1.497 1.915 0 CA-C-O 119.948 -0.072 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.7 ttp180 -146.7 141.02 26.38 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.184 1.393 . . . . 0.0 111.35 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.3 -164.22 35.87 Favored Glycine 0 CA--C 1.538 1.526 0 C-N-CA 124.815 1.198 . . . . 0.0 114.026 176.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 38.1 m -128.6 144.59 51.18 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.935 1.294 . . . . 0.0 111.325 175.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -91.35 122.26 33.8 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.489 1.115 . . . . 0.0 111.739 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.4 m-70 -149.06 146.24 27.64 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.605 1.562 . . . . 0.0 111.486 -177.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -154.22 117.05 4.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 125.39 1.476 . . . . 0.0 110.124 170.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -135.7 6.87 3.23 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 -170.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -62.33 125.97 25.73 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.217 -0.927 . . . . 0.0 112.486 -171.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -157.37 157.1 33.43 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.405 1.482 . . . . 0.0 111.662 -176.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 76.48 167.97 26.65 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 125.1 1.333 . . . . 0.0 114.93 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -154.9 153.74 31.57 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.142 1.377 . . . . 0.0 112.647 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 78.55 131.22 0.66 Allowed Glycine 0 CA--C 1.539 1.59 0 C-N-CA 125.349 1.452 . . . . 0.0 114.754 177.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . 49.43 41.73 21.3 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.826 1.65 . . . . 0.0 114.766 175.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.38 -43.72 88.59 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.493 1.117 . . . . 0.0 113.778 -172.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.77 148.88 29.06 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.247 1.019 . . . . 0.0 112.254 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.82 153.98 33.62 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.284 1.434 . . . . 0.0 114.423 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.6 mt -124.41 149.2 46.99 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.411 1.484 . . . . 0.0 111.884 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -69.31 140.35 54.35 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.806 0.842 . . . . 0.0 110.182 162.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -103.9 -16.96 15.21 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -139.08 159.87 41.14 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.749 1.22 . . . . 0.0 112.959 -170.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.92 -164.1 53.59 Favored Glycine 0 CA--C 1.541 1.686 0 C-N-CA 124.335 0.969 . . . . 0.0 114.37 177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.89 -24.15 75.14 Favored 'Trans proline' 0 CA--C 1.54 0.804 0 C-N-CA 123.611 2.874 . . . . 0.0 113.829 -179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.5 mp -84.38 -6.19 59.36 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.826 1.65 . . . . 0.0 113.528 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.61 125.82 17.74 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 119.841 1.201 . . . . 0.0 112.13 -179.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.35 -1.23 79.21 Favored Glycine 0 CA--C 1.53 0.984 0 N-CA-C 116.003 1.161 . . . . 0.0 116.003 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.5 mt -106.82 153.14 40.97 Favored Pre-proline 0 CA--C 1.55 0.957 0 CA-C-N 119.08 1.44 . . . . 0.0 112.382 -174.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -55.37 141.54 81.52 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 124.364 3.376 . . . . 0.0 112.901 178.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 33.5 t -76.44 -33.76 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 O-C-N 122.285 -0.259 . . . . 0.0 110.886 172.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.65 166.47 22.86 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.823 1.249 . . . . 0.0 113.015 -174.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -33.43 74.27 Favored 'General case' 0 N--CA 1.478 0.955 0 O-C-N 121.295 -0.878 . . . . 0.0 111.62 172.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 40.2 m -66.11 -40.11 90.48 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.48 0.712 . . . . 0.0 111.534 174.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -63.0 -45.63 91.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.771 0.714 . . . . 0.0 110.621 172.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.5 -46.58 89.4 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 118.723 0.692 . . . . 0.0 112.386 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -54.18 -49.74 68.64 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.026 1.73 . . . . 0.0 111.254 173.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.7 t -76.25 -31.33 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-O 118.343 -0.837 . . . . 0.0 112.426 -177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.1 mt -62.5 -47.44 83.96 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 120.431 1.469 . . . . 0.0 111.258 170.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 76.3 mt -62.14 -43.32 97.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.532 0.605 . . . . 0.0 110.69 175.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.37 -50.95 71.57 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.538 0.735 . . . . 0.0 112.325 177.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -69.04 -33.76 74.1 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.537 -0.727 . . . . 0.0 112.071 -177.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 53.6 tp10 -60.43 -54.71 42.35 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.663 0.785 . . . . 0.0 110.86 171.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 64.0 t90 -49.83 -47.01 51.8 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-O 118.144 -0.932 . . . . 0.0 112.306 169.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.3 tm-20 -64.02 -46.46 84.38 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 120.113 1.324 . . . . 0.0 112.131 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.6 -45.59 89.63 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.555 -0.716 . . . . 0.0 111.894 175.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -57.33 -49.45 76.08 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.875 -0.516 . . . . 0.0 110.633 174.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.9 tptt -55.62 -41.0 72.89 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.617 1.567 . . . . 0.0 112.183 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -65.76 -39.31 90.91 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.272 0.842 . . . . 0.0 113.272 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.3 m -77.87 -32.75 52.15 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -155.44 111.32 2.23 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 128.288 2.635 . . . . 0.0 109.393 -166.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -75.59 -11.95 20.4 Favored 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 124.016 3.144 . . . . 0.0 116.359 -160.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.4 p-90 -67.82 -30.73 70.21 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -171.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.1 tt -72.36 141.57 48.77 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.487 0.715 . . . . 0.0 111.768 -156.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -114.55 142.23 46.7 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.357 1.463 . . . . 0.0 111.887 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.408 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.7 OUTLIER -90.15 119.86 30.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.036 1.334 . . . . 0.0 110.304 -172.325 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -135.85 120.32 18.1 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.636 1.174 . . . . 0.0 111.741 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.408 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -150.19 54.76 0.92 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.962 1.305 . . . . 0.0 112.441 -177.478 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 97.3 p -63.79 163.41 11.76 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.346 1.058 . . . . 0.0 112.185 165.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -50.23 -44.0 53.18 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.996 0.919 . . . . 0.0 111.041 173.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -61.01 -44.36 97.53 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 124.466 1.106 . . . . 0.0 112.292 174.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.4 -39.53 87.68 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 119.381 0.991 . . . . 0.0 112.464 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -69.69 -48.16 66.78 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 118.969 -0.538 . . . . 0.0 110.072 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -69.34 -27.17 65.12 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 118.815 0.734 . . . . 0.0 112.764 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -72.96 -42.02 63.81 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.661 1.184 . . . . 0.0 112.691 172.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.1 mtt85 -73.14 -37.42 66.62 Favored 'General case' 0 N--CA 1.484 1.225 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 175.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.3 m-85 -134.84 82.63 43.26 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 126.067 1.747 . . . . 0.0 110.168 -168.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.63 -12.13 33.81 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.32 2.68 . . . . 0.0 114.679 -168.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 31.4 p-80 -79.05 -7.87 58.48 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.65 -31.14 26.34 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.611 1.096 . . . . 0.0 113.304 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 . . . . . 0 C--O 1.256 1.407 0 CA-C-N 119.386 0.994 . . . . 0.0 111.887 168.776 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.8 mtm . . . . . 0 N--CA 1.501 2.089 0 N-CA-C 110.413 -0.218 . . . . 0.0 110.413 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.5 ppt_? -153.42 169.78 22.31 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.811 1.244 . . . . 0.0 113.528 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.58 -3.7 71.93 Favored Glycine 0 CA--C 1.537 1.415 0 N-CA-C 117.071 1.588 . . . . 0.0 117.071 164.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 57.7 m -82.82 114.27 21.02 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 119.257 1.529 . . . . 0.0 111.971 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -97.01 141.53 30.05 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.239 1.016 . . . . 0.0 112.75 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -155.38 156.17 34.92 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.062 1.345 . . . . 0.0 110.442 162.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 49.8 p-80 -147.29 135.53 21.58 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.077 1.351 . . . . 0.0 111.296 172.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -154.98 158.0 38.53 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.507 1.123 . . . . 0.0 111.494 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -153.64 122.75 6.5 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.566 1.546 . . . . 0.0 109.978 168.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.8 t-80 -155.81 157.36 36.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.262 1.025 . . . . 0.0 112.634 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 85.36 155.06 24.0 Favored Glycine 0 CA--C 1.537 1.466 0 C-N-CA 125.283 1.421 . . . . 0.0 114.859 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -153.75 170.26 21.36 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.958 1.703 . . . . 0.0 111.995 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 60.75 -120.92 24.87 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 124.044 0.83 . . . . 0.0 113.401 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.84 -10.76 60.24 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 55.38 -160.71 0.18 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.889 1.676 . . . . 0.0 113.915 -177.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.69 141.23 57.05 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 -176.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.34 156.39 18.56 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.1 mt -128.09 148.58 50.57 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.399 1.48 . . . . 0.0 112.197 -177.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -71.29 141.77 50.5 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.127 0.971 . . . . 0.0 110.412 163.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -106.59 -15.15 14.85 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.096 1.517 . . . . 0.0 115.096 -172.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.69 158.95 43.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.625 1.17 . . . . 0.0 113.087 -170.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.63 -162.84 52.08 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.444 1.021 . . . . 0.0 114.396 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.44 -24.04 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 123.469 2.779 . . . . 0.0 113.839 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.08 -6.61 59.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.723 1.609 . . . . 0.0 113.64 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.85 125.2 16.19 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.934 1.243 . . . . 0.0 112.029 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.26 -0.44 78.27 Favored Glycine 0 CA--C 1.528 0.867 0 N-CA-C 115.971 1.148 . . . . 0.0 115.971 -177.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.7 mt -106.51 153.05 40.8 Favored Pre-proline 0 CA--C 1.55 0.978 0 CA-C-N 119.07 1.435 . . . . 0.0 112.537 -174.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -54.7 144.04 66.88 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 124.575 3.516 . . . . 0.0 113.213 177.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.7 t -80.91 -33.9 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 122.651 0.38 . . . . 0.0 110.896 172.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.1 p -130.97 165.77 22.43 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.763 1.225 . . . . 0.0 113.309 -175.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -62.82 -35.33 79.57 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.375 -0.828 . . . . 0.0 111.05 174.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.3 m -65.12 -41.46 94.86 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.157 0.983 . . . . 0.0 111.893 173.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -61.17 -46.39 90.68 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.957 0.799 . . . . 0.0 110.486 173.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.73 88.75 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.348 0.659 . . . . 0.0 112.51 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -61.57 -42.56 99.03 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.295 1.438 . . . . 0.0 112.099 177.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 67.6 t -73.83 -34.51 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.466 176.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.8 mt -62.89 -44.21 96.72 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 120.492 1.496 . . . . 0.0 111.287 172.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 88.5 mt -62.26 -42.99 97.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 118.214 0.461 . . . . 0.0 110.815 173.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -57.89 -52.81 63.96 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.744 0.702 . . . . 0.0 112.179 175.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -63.14 -41.17 99.24 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 118.719 0.69 . . . . 0.0 112.093 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -59.09 -51.21 71.02 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.989 0.516 . . . . 0.0 111.062 175.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 75.2 t90 -54.23 -45.36 72.28 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-O 118.123 -0.942 . . . . 0.0 111.915 171.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.12 -46.64 83.27 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.034 1.288 . . . . 0.0 112.204 -173.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -65.73 -42.84 90.57 Favored 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.443 -0.785 . . . . 0.0 111.882 176.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -60.4 -50.02 75.27 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 121.673 -0.642 . . . . 0.0 111.193 175.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -55.22 -40.85 71.31 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.972 1.709 . . . . 0.0 112.03 177.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -64.98 -40.17 94.58 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.59 0.756 . . . . 0.0 112.697 173.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 75.5 m -80.62 -29.31 36.81 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 115.381 1.623 . . . . 0.0 115.381 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -150.98 110.15 3.07 Favored Pre-proline 0 CA--C 1.552 1.044 0 C-N-CA 128.225 2.61 . . . . 0.0 109.254 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -75.1 -11.52 21.3 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 123.765 2.977 . . . . 0.0 116.115 -161.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 7.7 p-90 -76.73 -19.94 57.1 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 115.698 1.74 . . . . 0.0 115.698 -170.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 18.9 tp -72.33 147.85 45.91 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.455 1.025 . . . . 0.0 113.452 -164.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.0 ttt180 -114.02 149.66 35.07 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 125.124 1.37 . . . . 0.0 112.189 173.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.451 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -94.22 121.08 35.36 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.61 1.564 . . . . 0.0 109.681 -175.209 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -137.55 112.4 8.95 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.196 0.999 . . . . 0.0 111.945 178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.451 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -149.47 51.69 0.94 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.833 1.253 . . . . 0.0 113.099 -177.025 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.7 t -66.2 157.34 31.65 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.74 160.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -52.71 -36.9 58.23 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.145 0.978 . . . . 0.0 112.338 -179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -63.58 -37.44 87.32 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.81 0.844 . . . . 0.0 112.491 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.65 -39.39 91.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 118.962 0.801 . . . . 0.0 111.249 172.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.83 -46.5 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-O 119.018 -0.515 . . . . 0.0 110.228 177.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -71.15 -27.17 63.35 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.994 0.815 . . . . 0.0 112.719 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.67 -46.17 73.12 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.983 0.913 . . . . 0.0 112.152 171.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 40.1 mmt180 -79.49 -30.8 42.15 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -134.4 77.79 58.91 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 126.173 1.789 . . . . 0.0 110.377 -172.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -69.42 -8.78 24.52 Favored 'Trans proline' 0 CA--C 1.538 0.714 0 C-N-CA 123.643 2.895 . . . . 0.0 114.997 -168.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -81.58 -9.5 59.66 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 176.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.54 -45.68 24.65 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.177 0.899 . . . . 0.0 111.848 177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 . . . . . 0 N--CA 1.485 1.314 0 N-CA-C 117.216 2.302 . . . . 0.0 117.216 177.558 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 110.78 -0.082 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.8 ttp180 -146.17 146.83 30.98 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.411 1.485 . . . . 0.0 111.382 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 74.3 14.71 80.55 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.3 0.952 . . . . 0.0 115.054 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.5 p -103.61 178.99 4.4 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.894 2.078 . . . . 0.0 113.134 -175.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 7.3 m80 62.09 -166.14 0.22 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 126.355 1.862 . . . . 0.0 113.516 -179.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.1 t60 57.08 54.88 6.48 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.618 1.567 . . . . 0.0 113.209 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -136.75 -174.06 3.61 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.204 1.802 . . . . 0.0 111.21 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.5 m80 58.75 30.96 20.69 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 126.181 1.793 . . . . 0.0 114.789 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -62.62 143.07 57.71 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.244 1.018 . . . . 0.0 112.57 175.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.3 t60 -146.88 156.09 42.82 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.875 1.27 . . . . 0.0 111.812 172.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -176.48 -173.49 42.14 Favored Glycine 0 CA--C 1.535 1.319 0 C-N-CA 124.699 1.142 . . . . 0.0 113.923 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.6 t 61.99 168.6 0.11 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.307 1.843 . . . . 0.0 114.54 -170.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 63.15 -156.64 41.14 Favored Glycine 0 CA--C 1.539 1.534 0 C-N-CA 124.574 1.083 . . . . 0.0 113.215 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.97 130.69 35.48 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.6 0.76 . . . . 0.0 111.538 172.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -83.13 175.98 9.56 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.546 1.138 . . . . 0.0 111.813 174.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.65 138.68 40.88 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -168.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -106.7 159.12 16.46 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.611 1.565 . . . . 0.0 114.068 172.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -129.02 149.83 50.68 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.411 1.485 . . . . 0.0 111.538 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -68.85 130.3 42.39 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.311 0.644 . . . . 0.0 109.828 162.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.05 -24.07 17.75 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -141.26 164.11 31.14 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.363 1.465 . . . . 0.0 112.275 -172.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.98 -167.41 54.67 Favored Glycine 0 CA--C 1.542 1.773 0 C-N-CA 124.179 0.895 . . . . 0.0 114.637 177.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -56.44 -28.32 72.59 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 124.114 3.209 . . . . 0.0 114.685 -173.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.0 mt -95.63 2.96 54.39 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.081 1.353 . . . . 0.0 113.536 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.61 127.28 15.34 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 118.946 0.793 . . . . 0.0 112.396 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.81 -4.65 75.75 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -176.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.5 mt -107.11 155.4 39.35 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 118.932 1.366 . . . . 0.0 112.487 -173.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -55.04 145.5 63.42 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 124.337 3.358 . . . . 0.0 112.814 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.9 t -81.62 -32.05 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 O-C-N 122.062 -0.399 . . . . 0.0 110.778 171.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -134.45 167.26 21.08 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.783 1.233 . . . . 0.0 113.487 -175.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 50.2 mtm180 -62.57 -34.8 77.7 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 121.639 -0.663 . . . . 0.0 111.942 173.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 22.1 t -66.16 -42.73 88.6 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.607 0.763 . . . . 0.0 111.243 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -60.2 -46.71 88.8 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.676 -0.64 . . . . 0.0 110.672 173.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.75 -46.91 88.63 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.706 0.802 . . . . 0.0 112.394 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 -61.95 -42.05 98.67 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.56 1.144 . . . . 0.0 112.041 177.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 62.0 t -72.81 -35.08 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.336 175.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.06 -43.99 97.07 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 120.542 1.519 . . . . 0.0 111.294 173.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 54.6 mt -63.76 -40.39 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 118.529 0.604 . . . . 0.0 110.741 174.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -60.22 -50.26 74.35 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.841 0.746 . . . . 0.0 112.195 175.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.3 t30 -64.0 -38.52 91.38 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.438 0.695 . . . . 0.0 112.265 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -60.22 -53.79 53.49 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.992 0.917 . . . . 0.0 110.951 173.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 67.9 t90 -54.08 -46.27 72.0 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 118.531 -0.747 . . . . 0.0 111.264 173.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -63.76 -45.62 88.99 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.293 0.951 . . . . 0.0 112.39 -173.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -64.09 -49.42 72.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 123.758 0.823 . . . . 0.0 111.763 176.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -61.09 -49.15 78.49 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.817 -0.552 . . . . 0.0 111.252 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -56.93 -41.29 77.95 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.111 1.364 . . . . 0.0 112.817 175.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -64.01 -33.67 76.27 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 119.605 1.093 . . . . 0.0 112.777 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.3 t -77.6 -37.41 50.41 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 172.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -150.11 107.42 3.2 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 128.003 2.521 . . . . 0.0 109.952 -172.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -74.04 -12.33 23.62 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.338 3.359 . . . . 0.0 117.13 -157.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 21.7 p-90 -69.75 -19.79 63.52 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.397 1.629 . . . . 0.0 115.397 -172.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 36.1 tp -67.27 138.79 57.13 Favored 'General case' 0 CA--C 1.547 0.835 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -159.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -83.83 148.78 26.8 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.54 1.536 . . . . 0.0 111.72 174.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.3 tt -114.91 119.56 36.98 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.767 1.627 . . . . 0.0 109.15 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -139.12 114.5 9.71 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.468 1.107 . . . . 0.0 111.487 174.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.66 49.58 1.14 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 50.0 m -73.62 161.01 30.78 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 123.736 0.814 . . . . 0.0 110.993 160.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -51.84 -38.25 55.13 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.953 0.901 . . . . 0.0 113.175 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.3 ptmm? -60.0 -40.85 90.62 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 173.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.24 -38.17 89.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.74 -47.02 87.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 119.067 -0.492 . . . . 0.0 110.403 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -69.46 -31.79 70.31 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.947 0.794 . . . . 0.0 112.562 -178.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 20.6 mmt85 -70.39 -37.2 74.46 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.841 0.857 . . . . 0.0 113.257 174.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 33.6 mtt180 -73.14 -41.22 64.2 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-N 119.03 0.832 . . . . 0.0 112.85 171.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.9 82.42 64.23 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.728 1.611 . . . . 0.0 110.156 -165.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -70.07 -10.11 27.56 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.484 2.789 . . . . 0.0 114.589 -167.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.5 p-80 -78.52 -10.31 59.67 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 175.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.5 -31.64 32.77 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 119.508 1.049 . . . . 0.0 113.316 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.253 1.281 0 CA-C-N 119.577 1.081 . . . . 0.0 112.728 171.975 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.4 ttp . . . . . 0 N--CA 1.496 1.84 0 N-CA-C 110.864 -0.051 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 88.2 mtm180 -126.05 155.15 41.97 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 125.664 1.586 . . . . 0.0 111.524 175.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -167.07 6.81 0.05 OUTLIER Glycine 0 CA--C 1.538 1.484 0 N-CA-C 116.779 1.471 . . . . 0.0 116.779 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -89.85 137.02 32.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.158 1.479 . . . . 0.0 112.453 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -145.6 144.68 30.61 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.573 1.549 . . . . 0.0 111.768 -178.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.0 p-80 -154.72 144.21 21.36 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.137 1.375 . . . . 0.0 111.711 173.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -158.33 146.98 18.87 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.801 1.24 . . . . 0.0 111.327 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -154.31 148.47 25.86 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.964 1.306 . . . . 0.0 111.317 175.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -151.9 164.03 37.98 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.647 1.179 . . . . 0.0 113.547 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -131.11 161.89 31.1 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.977 1.711 . . . . 0.0 112.035 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 85.74 142.19 6.29 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 124.856 1.217 . . . . 0.0 112.702 -169.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -127.0 4.58 6.5 Favored 'General case' 0 N--CA 1.482 1.154 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -160.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 62.04 28.76 71.02 Favored Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.988 1.155 . . . . 0.0 115.988 170.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -79.14 49.5 0.96 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 125.668 1.587 . . . . 0.0 114.969 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 pp -81.58 -10.34 59.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.6 145.33 56.2 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.484 1.113 . . . . 0.0 113.438 -177.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.16 151.07 26.95 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 114.796 1.406 . . . . 0.0 114.796 -179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -122.94 149.16 44.62 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.622 1.569 . . . . 0.0 111.964 -179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -69.08 141.5 54.73 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.85 0.86 . . . . 0.0 110.438 162.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.51 -15.96 14.85 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 -172.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -138.87 159.1 42.94 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.726 1.211 . . . . 0.0 113.158 -170.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.09 -163.57 52.4 Favored Glycine 0 CA--C 1.543 1.816 0 C-N-CA 124.364 0.983 . . . . 0.0 114.44 177.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -59.06 -24.35 73.15 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.545 2.83 . . . . 0.0 113.99 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.1 -6.82 59.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.706 1.603 . . . . 0.0 113.625 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.74 125.44 16.76 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.68 1.127 . . . . 0.0 111.967 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.36 -0.93 78.75 Favored Glycine 0 CA--C 1.532 1.096 0 N-CA-C 116.102 1.201 . . . . 0.0 116.102 -177.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.8 mt -107.59 153.21 41.52 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 119.127 1.464 . . . . 0.0 112.082 -174.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -55.09 143.49 73.74 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.435 3.423 . . . . 0.0 113.492 179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.5 t -78.01 -37.8 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 121.983 -0.448 . . . . 0.0 111.358 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 6.9 t -139.06 166.1 25.39 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.367 1.467 . . . . 0.0 112.671 176.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -57.68 -29.44 64.65 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 121.094 -1.004 . . . . 0.0 112.896 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -62.38 -43.07 99.7 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.572 0.749 . . . . 0.0 111.941 172.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -64.68 -43.15 94.45 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.565 -0.71 . . . . 0.0 110.259 172.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.45 -46.83 88.43 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 179.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -57.12 -46.9 82.28 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.02 1.328 . . . . 0.0 111.417 173.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 72.4 t -72.69 -32.45 40.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 118.862 -0.59 . . . . 0.0 112.439 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 51.7 mt -65.33 -42.38 93.01 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 120.179 1.354 . . . . 0.0 111.291 171.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.1 mt -64.3 -40.36 88.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-N 118.732 0.696 . . . . 0.0 110.762 173.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -60.74 -52.04 66.79 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.776 0.716 . . . . 0.0 112.158 174.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -61.78 -39.96 93.51 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 118.532 0.605 . . . . 0.0 111.807 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -59.38 -54.51 45.89 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.915 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.1 t90 -51.62 -46.32 63.58 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 119.386 0.994 . . . . 0.0 111.458 173.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -65.37 -45.36 84.41 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.879 0.763 . . . . 0.0 111.953 -172.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 80.8 mt-10 -70.4 -42.52 71.55 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.37 -0.831 . . . . 0.0 111.927 178.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -58.48 -48.89 79.29 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 121.61 -0.681 . . . . 0.0 110.683 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -63.51 -40.01 95.92 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.516 1.527 . . . . 0.0 112.46 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -65.86 -29.91 70.44 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.865 0.757 . . . . 0.0 112.444 172.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.7 t -79.21 -37.53 37.94 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 171.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -149.04 105.67 3.38 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 127.892 2.477 . . . . 0.0 110.021 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.98 -11.63 25.58 Favored 'Trans proline' 0 CA--C 1.541 0.875 0 C-N-CA 124.648 3.566 . . . . 0.0 117.17 -157.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 15.8 p-90 -69.1 -23.34 64.0 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -173.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 141.78 57.17 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -161.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 11.8 mpt_? -98.29 148.12 23.96 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.052 1.341 . . . . 0.0 111.983 172.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 tt -98.63 118.94 36.47 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.683 1.593 . . . . 0.0 109.286 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -134.54 115.81 14.33 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.406 1.082 . . . . 0.0 111.279 176.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.99 51.4 0.91 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.439 1.095 . . . . 0.0 113.406 -178.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 35.4 t -63.89 155.54 30.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.709 160.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -56.98 -29.96 63.69 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 120.813 -1.179 . . . . 0.0 112.335 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -60.22 -41.85 93.97 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 121.424 -0.798 . . . . 0.0 112.53 170.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -64.34 -37.29 86.98 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.679 0.792 . . . . 0.0 111.939 172.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -65.46 -48.1 84.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 CA-C-O 118.948 -0.548 . . . . 0.0 110.514 175.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -66.88 -33.14 74.95 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.048 0.84 . . . . 0.0 112.288 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -69.3 -39.79 78.07 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.287 1.035 . . . . 0.0 113.002 174.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.0 -37.38 61.84 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 174.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -133.07 85.57 45.14 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.72 1.608 . . . . 0.0 110.281 -168.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -68.84 -16.09 41.13 Favored 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 123.161 2.574 . . . . 0.0 114.619 -166.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 29.5 p-80 -75.2 -11.68 60.13 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 175.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -77.91 -26.93 49.36 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.095 0.861 . . . . 0.0 112.31 175.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 . . . . . 0 C--O 1.254 1.328 0 C-N-CA 128.272 2.629 . . . . 0.0 116.757 161.759 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.0 mtt . . . . . 0 N--CA 1.496 1.836 0 CA-C-O 120.344 0.116 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.0 ptp85 -69.26 164.1 23.51 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.501 1.121 . . . . 0.0 113.415 178.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -161.84 -174.15 31.38 Favored Glycine 0 CA--C 1.535 1.309 0 C-N-CA 124.925 1.25 . . . . 0.0 113.78 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.8 t -151.96 -58.87 0.15 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 125.053 1.341 . . . . 0.0 110.748 177.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.5 m80 55.29 29.33 12.71 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.842 1.657 . . . . 0.0 115.431 166.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -71.68 148.23 46.66 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.986 0.914 . . . . 0.0 112.603 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -147.51 142.39 26.87 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 125.874 1.67 . . . . 0.0 110.408 172.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -138.02 131.55 30.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.402 1.081 . . . . 0.0 111.902 -175.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -153.97 150.16 28.01 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 125.811 1.644 . . . . 0.0 110.346 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -152.38 150.85 30.13 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.517 1.127 . . . . 0.0 112.994 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 174.95 117.51 0.48 Allowed Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.672 1.606 . . . . 0.0 111.012 172.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -155.58 140.06 16.83 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.177 0.991 . . . . 0.0 112.356 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 74.28 162.38 8.66 Favored Glycine 0 CA--C 1.54 1.64 0 C-N-CA 125.466 1.507 . . . . 0.0 115.694 176.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -155.96 147.37 22.67 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 126.357 1.863 . . . . 0.0 110.84 171.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.9 pp -93.33 -12.97 28.74 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.47 149.36 44.25 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.437 1.095 . . . . 0.0 113.357 -178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.78 148.26 26.81 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -179.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.9 mt -123.75 151.08 43.64 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.86 1.664 . . . . 0.0 111.825 -178.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -69.56 131.68 45.05 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.512 0.725 . . . . 0.0 109.88 161.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.43 -22.55 17.63 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -175.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -140.24 162.92 34.12 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.132 1.373 . . . . 0.0 112.647 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.14 -164.45 54.92 Favored Glycine 0 CA--C 1.542 1.771 0 C-N-CA 124.169 0.89 . . . . 0.0 114.463 176.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.67 -28.94 68.54 Favored 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 123.915 3.076 . . . . 0.0 114.646 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 79.9 mt -94.09 1.75 56.11 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.893 1.277 . . . . 0.0 113.542 -176.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.88 125.59 12.23 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.196 0.907 . . . . 0.0 112.268 -179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.95 -3.39 73.58 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 116.165 1.226 . . . . 0.0 116.165 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.2 mt -107.55 154.9 40.5 Favored Pre-proline 0 CA--C 1.551 1.006 0 CA-C-N 118.977 1.389 . . . . 0.0 112.566 -173.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -56.0 145.26 75.4 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.178 3.252 . . . . 0.0 113.008 176.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.2 t -79.18 -28.97 13.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 O-C-N 122.252 -0.28 . . . . 0.0 111.398 172.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.5 p -140.94 165.37 27.71 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.863 1.265 . . . . 0.0 112.262 -174.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -65.02 -27.08 68.56 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.172 -0.955 . . . . 0.0 112.694 173.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.3 t -69.07 -43.69 74.08 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.339 0.655 . . . . 0.0 111.444 172.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -61.96 -41.95 98.57 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.247 -0.908 . . . . 0.0 110.908 172.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.64 85.18 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.574 0.749 . . . . 0.0 112.693 176.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -57.5 -44.91 85.35 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 125.99 1.716 . . . . 0.0 111.757 174.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.6 t -73.26 -35.23 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-O 118.331 -0.842 . . . . 0.0 112.218 178.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.69 -45.27 93.56 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 120.605 1.548 . . . . 0.0 111.314 173.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 72.2 mt -62.52 -43.45 98.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-N 118.272 0.487 . . . . 0.0 110.471 174.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -59.73 -50.64 73.03 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.878 -0.514 . . . . 0.0 112.342 176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -32.69 68.65 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.509 -0.744 . . . . 0.0 111.763 -175.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.45 -48.88 73.63 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.611 0.765 . . . . 0.0 110.918 171.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 68.2 t90 -55.2 -44.69 75.57 Favored 'General case' 0 C--O 1.219 -0.52 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.788 170.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -65.8 -45.68 81.48 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 120.05 1.296 . . . . 0.0 112.093 -175.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -61.79 -46.57 88.99 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.945 -0.472 . . . . 0.0 111.695 174.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -58.05 -51.34 70.09 Favored 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.069 0.547 . . . . 0.0 111.156 174.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 48.5 tptt -53.7 -40.35 65.94 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.526 1.531 . . . . 0.0 111.968 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -68.53 -39.15 81.28 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 172.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 74.0 m -75.9 -29.36 58.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 115.266 1.58 . . . . 0.0 115.266 175.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -154.2 105.02 2.42 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 128.732 2.813 . . . . 0.0 109.01 -162.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -73.67 -15.21 24.4 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.452 2.768 . . . . 0.0 116.164 -161.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 17.4 p-90 -71.7 -25.29 62.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 -170.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.7 tp -69.46 145.89 52.39 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -157.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -107.63 151.69 25.3 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 126.29 1.836 . . . . 0.0 111.994 172.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.421 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -105.11 119.49 39.17 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.678 1.591 . . . . 0.0 109.879 -176.297 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -135.79 120.47 18.35 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.609 1.163 . . . . 0.0 111.625 176.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.421 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.92 57.16 0.73 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.732 1.213 . . . . 0.0 112.639 -176.151 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 94.1 p -65.09 160.56 20.81 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.532 163.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -52.45 -39.21 60.8 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.203 -0.936 . . . . 0.0 111.279 174.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.1 -43.81 98.32 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.313 1.045 . . . . 0.0 112.546 173.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.76 85.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.665 1.121 . . . . 0.0 112.072 174.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.91 -47.12 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.117 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -68.04 -31.15 70.62 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 118.704 0.684 . . . . 0.0 112.639 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -71.22 -40.57 71.01 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.632 1.173 . . . . 0.0 112.964 174.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.2 mtp85 -73.42 -37.89 65.76 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.843 0.747 . . . . 0.0 112.937 174.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -130.72 85.34 55.99 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.853 1.661 . . . . 0.0 110.076 -168.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -70.41 -8.95 24.82 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.448 2.765 . . . . 0.0 114.852 -168.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -81.24 -9.31 59.8 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.67 -35.09 30.31 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.3 0.954 . . . . 0.0 113.223 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.315 0 CA-C-O 117.426 -1.273 . . . . 0.0 112.645 173.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 mpp? . . . . . 0 N--CA 1.501 2.081 0 CA-C-O 118.544 -0.741 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 48.92 53.67 12.11 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.464 1.506 . . . . 0.0 113.038 -169.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.11 -160.82 10.25 Favored Glycine 0 CA--C 1.537 1.421 0 C-N-CA 124.748 1.166 . . . . 0.0 114.249 -175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 t 65.45 152.25 0.06 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 127.105 2.162 . . . . 0.0 114.856 -169.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -155.77 131.53 9.81 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.859 1.664 . . . . 0.0 110.83 -174.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.9 t60 -155.51 138.69 15.61 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.329 1.051 . . . . 0.0 112.286 175.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -142.55 145.89 34.08 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.199 1.8 . . . . 0.0 111.102 174.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -149.78 161.91 41.3 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.528 1.131 . . . . 0.0 111.99 175.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 62.52 148.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 128.611 2.764 . . . . 0.0 115.648 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 p80 -150.14 26.29 0.79 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.879 1.272 . . . . 0.0 113.51 -176.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -59.95 -30.11 69.25 Favored Glycine 0 CA--C 1.54 1.627 0 C-N-CA 124.597 1.094 . . . . 0.0 115.37 -174.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 t 42.49 56.08 3.9 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 126.54 1.936 . . . . 0.0 114.626 167.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -65.61 106.72 1.64 Allowed Glycine 0 CA--C 1.535 1.322 0 O-C-N 121.295 -0.878 . . . . 0.0 114.096 -169.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -103.06 3.9 36.58 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 114.976 1.473 . . . . 0.0 114.976 -172.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 pp -75.17 -11.08 60.0 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 -170.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.43 142.01 58.32 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.063 0.945 . . . . 0.0 113.359 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.73 154.06 22.04 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.0 mt -125.77 148.81 48.98 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.442 1.497 . . . . 0.0 112.318 -177.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -70.61 142.06 51.71 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.316 1.047 . . . . 0.0 110.503 163.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.91 -15.99 14.77 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.992 1.478 . . . . 0.0 114.992 -172.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.0 159.27 42.55 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.565 1.146 . . . . 0.0 113.07 -170.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.1 -162.91 52.75 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.385 0.993 . . . . 0.0 114.322 177.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.59 -24.18 74.15 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.46 2.773 . . . . 0.0 113.799 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -84.16 -6.22 59.37 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 125.655 1.582 . . . . 0.0 113.699 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.99 125.67 17.97 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.822 1.192 . . . . 0.0 111.99 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.68 -0.56 80.18 Favored Glycine 0 CA--C 1.53 1.004 0 N-CA-C 115.965 1.146 . . . . 0.0 115.965 -177.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.2 mt -106.78 153.38 40.79 Favored Pre-proline 0 CA--C 1.549 0.924 0 CA-C-N 119.1 1.45 . . . . 0.0 112.476 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -56.09 142.46 86.07 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 124.423 3.416 . . . . 0.0 113.07 178.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.7 t -77.82 -33.29 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 122.461 0.305 . . . . 0.0 110.937 173.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -134.18 164.72 26.72 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.787 1.235 . . . . 0.0 112.709 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -63.58 -29.19 70.48 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 121.119 -0.988 . . . . 0.0 112.53 173.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 28.8 m -68.36 -41.03 81.27 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.704 0.802 . . . . 0.0 111.292 173.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -61.68 -45.64 93.12 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.792 0.723 . . . . 0.0 110.588 172.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.49 -47.41 86.28 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.262 0.625 . . . . 0.0 112.488 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.8 ttt85 -59.92 -42.18 93.37 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.425 1.49 . . . . 0.0 112.089 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 70.2 t -75.72 -33.12 25.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-O 118.411 -0.804 . . . . 0.0 112.385 177.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 56.9 mt -62.63 -42.64 99.71 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 120.737 1.608 . . . . 0.0 111.331 170.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 61.5 mt -63.21 -42.78 97.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 122.991 0.517 . . . . 0.0 110.667 174.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 t80 -59.11 -47.03 86.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.659 0.663 . . . . 0.0 112.425 173.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -68.39 -37.46 80.39 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.835 -0.541 . . . . 0.0 111.998 -177.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -63.17 -50.38 70.59 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 118.519 -0.753 . . . . 0.0 110.729 171.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -53.93 -43.61 69.95 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.765 1.166 . . . . 0.0 112.468 173.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -56.18 -50.62 70.67 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.971 1.26 . . . . 0.0 111.765 175.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -65.59 -48.03 73.7 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 178.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -56.07 -51.35 68.14 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.455 1.102 . . . . 0.0 110.632 176.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 91' ' ' LYS . 1.0 OUTLIER -56.41 -44.25 80.13 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.463 1.505 . . . . 0.0 111.883 176.23 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -61.91 -33.88 75.04 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.396 0.998 . . . . 0.0 112.848 175.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 66.9 m -78.68 -38.14 40.08 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -152.21 102.97 2.78 Favored Pre-proline 0 CA--C 1.556 1.196 0 C-N-CA 127.749 2.42 . . . . 0.0 109.659 -169.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.24 -14.08 25.66 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.966 3.111 . . . . 0.0 116.576 -160.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -65.83 -24.18 66.84 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -172.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.4 tp -64.62 145.03 56.77 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 118.78 0.718 . . . . 0.0 112.614 -165.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 85.5 mtt85 -102.34 150.28 23.49 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.955 1.302 . . . . 0.0 112.406 172.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.423 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.4 OUTLIER -102.38 115.94 31.6 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 109.497 -176.781 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.59 118.48 16.25 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.467 1.107 . . . . 0.0 111.842 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.423 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -156.12 54.41 0.57 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.592 1.157 . . . . 0.0 113.429 -173.054 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.1 t -75.07 163.35 27.67 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.594 0.758 . . . . 0.0 111.109 163.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -50.37 -39.45 46.63 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.688 1.195 . . . . 0.0 112.714 -177.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -61.55 -40.03 93.23 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.846 0.859 . . . . 0.0 112.719 175.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.99 88.5 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.517 0.727 . . . . 0.0 111.558 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.01 -46.64 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.346 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -68.0 -33.18 74.13 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.447 0.567 . . . . 0.0 112.342 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 76.9 ttt-85 -68.37 -41.17 80.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.594 0.758 . . . . 0.0 112.393 174.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 88.6 mtt-85 -73.44 -37.7 65.77 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.859 0.864 . . . . 0.0 112.785 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -134.55 88.0 30.33 Favored Pre-proline 0 CA--C 1.548 0.882 0 C-N-CA 125.976 1.71 . . . . 0.0 110.33 -170.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -69.22 -14.54 37.98 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.177 2.585 . . . . 0.0 114.672 -167.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -78.48 -6.87 56.6 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 177.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -86.1 -30.13 22.8 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.993 1.108 . . . . 0.0 113.993 -179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 . . . . . 0 C--O 1.255 1.39 0 CA-C-N 119.342 0.974 . . . . 0.0 113.098 178.369 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttm . . . . . 0 N--CA 1.497 1.921 0 CA-C-O 119.604 -0.236 . . . . 0.0 111.068 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -84.38 -34.48 23.58 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.661 0.784 . . . . 0.0 112.936 173.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.76 162.35 14.52 Favored Glycine 0 CA--C 1.538 1.524 0 C-N-CA 124.839 1.209 . . . . 0.0 113.619 -174.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 t -157.09 175.76 13.65 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 124.375 1.07 . . . . 0.0 112.498 -177.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.6 m80 57.97 110.78 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 128.938 2.895 . . . . 0.0 115.156 177.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -137.54 146.92 44.71 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.901 1.281 . . . . 0.0 111.838 175.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -155.34 -173.46 4.56 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.899 1.68 . . . . 0.0 111.394 -175.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.2 p-80 -140.73 145.3 36.26 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.245 1.018 . . . . 0.0 113.029 172.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -142.86 173.12 11.83 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.817 2.047 . . . . 0.0 111.247 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.2 m-70 64.26 -178.88 0.17 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 126.367 1.867 . . . . 0.0 114.706 173.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -173.58 -179.52 44.29 Favored Glycine 0 CA--C 1.534 1.246 0 C-N-CA 124.133 0.873 . . . . 0.0 114.285 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.0 p -67.02 152.6 45.49 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.68 1.192 . . . . 0.0 113.114 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.33 -11.23 31.8 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.782 1.182 . . . . 0.0 115.429 -177.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -132.39 18.54 4.39 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.118 1.767 . . . . 0.0 113.174 178.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.406 HD23 ' H ' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -77.81 165.04 24.66 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.186 1.395 . . . . 0.0 112.028 -177.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.406 ' H ' HD23 ' A' ' 60' ' ' LEU . . . -56.85 145.43 29.67 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -171.3 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.23 154.33 31.35 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.663 1.585 . . . . 0.0 113.88 170.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -121.81 149.58 43.13 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.457 1.503 . . . . 0.0 111.851 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -68.33 141.14 55.89 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.911 0.884 . . . . 0.0 110.487 162.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -104.14 -16.69 15.17 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -172.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -139.14 159.85 41.18 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.616 1.166 . . . . 0.0 112.862 -170.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 70.77 -164.39 53.23 Favored Glycine 0 CA--C 1.541 1.679 0 C-N-CA 124.248 0.928 . . . . 0.0 114.419 177.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -59.71 -24.05 74.09 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.489 2.793 . . . . 0.0 113.943 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.37 -6.14 59.35 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.749 1.62 . . . . 0.0 113.691 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.66 126.04 18.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 119.825 1.193 . . . . 0.0 112.037 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.22 -1.61 80.1 Favored Glycine 0 CA--C 1.53 0.99 0 N-CA-C 115.987 1.155 . . . . 0.0 115.987 -177.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 29.8 mt -107.28 153.32 41.22 Favored Pre-proline 0 CA--C 1.551 1.002 0 CA-C-N 119.063 1.431 . . . . 0.0 112.238 -174.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -56.97 144.31 89.73 Favored 'Trans proline' 0 C--N 1.353 0.776 0 C-N-CA 124.315 3.343 . . . . 0.0 113.043 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 43.7 t -78.61 -36.12 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 122.596 0.358 . . . . 0.0 111.493 177.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 5.5 t -140.98 166.12 25.66 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.402 1.481 . . . . 0.0 112.838 176.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -57.21 -28.96 63.32 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.409 1.484 . . . . 0.0 113.365 178.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.4 t -63.99 -42.07 97.32 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.371 0.668 . . . . 0.0 111.94 171.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -65.46 -45.04 85.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.173 -0.954 . . . . 0.0 110.326 173.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.48 -43.9 89.15 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.639 0.654 . . . . 0.0 112.396 178.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -60.29 -47.7 84.89 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.185 1.394 . . . . 0.0 111.676 174.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 74.1 t -69.35 -34.27 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 121.388 -0.82 . . . . 0.0 112.277 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 78.5 mt -64.6 -43.65 93.11 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 120.505 1.502 . . . . 0.0 111.701 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 89.5 mt -68.0 -37.4 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 CA-C-N 118.622 0.646 . . . . 0.0 110.893 175.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 80.4 t80 -59.93 -49.64 76.89 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 118.772 0.714 . . . . 0.0 111.993 171.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -60.78 -39.78 90.11 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.787 0.835 . . . . 0.0 111.788 178.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -60.49 -57.73 11.49 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 117.853 -1.07 . . . . 0.0 111.319 171.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 60.1 t90 -52.6 -46.75 67.09 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 120.127 1.33 . . . . 0.0 112.038 177.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.1 tm-20 -65.37 -43.32 91.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.035 0.934 . . . . 0.0 112.302 -174.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.43 -47.94 71.57 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.578 -0.701 . . . . 0.0 111.886 175.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 28.1 mmt-85 -59.82 -44.79 93.84 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.57 0.748 . . . . 0.0 110.469 177.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -62.65 -35.75 80.63 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.983 1.313 . . . . 0.0 112.474 176.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -63.78 -39.08 93.4 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 119.341 0.973 . . . . 0.0 112.808 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 69.2 m -75.58 -36.27 60.39 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 175.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -149.92 103.4 3.2 Favored Pre-proline 0 CA--C 1.555 1.158 0 C-N-CA 127.637 2.375 . . . . 0.0 109.488 -170.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.56 -12.52 27.02 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.187 3.258 . . . . 0.0 116.632 -159.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.9 p-90 -68.93 -23.03 64.12 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 32.3 tp -64.16 132.44 50.41 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -160.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.7 tpm_? -85.01 133.02 34.26 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.192 1.397 . . . . 0.0 110.601 170.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 2.8 tt -79.44 118.12 21.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.961 0.904 . . . . 0.0 108.72 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -122.07 115.38 22.38 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.49 0.716 . . . . 0.0 111.364 171.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -155.9 142.3 18.51 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 122.448 1.118 . . . . 0.0 112.968 164.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 28.9 t -152.1 171.62 17.6 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 128.766 2.827 . . . . 0.0 107.169 166.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -53.98 -34.1 58.86 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.612 -1.305 . . . . 0.0 112.96 -176.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -60.32 -42.29 95.3 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.705 0.802 . . . . 0.0 112.848 171.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.5 87.74 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.851 0.861 . . . . 0.0 111.902 174.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.67 -44.93 85.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 CA-C-O 119.375 -0.345 . . . . 0.0 110.132 178.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 13.1 m-30 -67.92 -34.81 77.33 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 118.316 0.507 . . . . 0.0 112.069 177.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 ttt180 -65.18 -43.79 90.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.15 0.98 . . . . 0.0 112.176 175.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -74.79 -40.91 60.86 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.392 0.677 . . . . 0.0 112.328 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -125.99 90.28 50.6 Favored Pre-proline 0 CA--C 1.55 0.96 0 C-N-CA 125.859 1.664 . . . . 0.0 110.39 -172.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -69.04 -15.87 40.14 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.07 2.513 . . . . 0.0 114.696 -166.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -79.91 -6.89 58.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 178.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -84.51 -28.78 26.48 Favored 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--O 1.254 1.299 0 CA-C-N 119.202 0.91 . . . . 0.0 112.86 177.603 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.9 mtm . . . . . 0 N--CA 1.499 1.977 0 CA-C-O 120.221 0.058 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 155.55 35.58 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.978 0.911 . . . . 0.0 112.735 176.188 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.55 -169.42 37.37 Favored Glycine 0 CA--C 1.538 1.522 0 C-N-CA 124.102 0.858 . . . . 0.0 113.692 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.3 m -101.52 -43.27 5.95 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.378 1.071 . . . . 0.0 112.669 178.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -149.65 23.95 0.88 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.103 1.361 . . . . 0.0 112.182 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -101.09 -8.16 22.55 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 -157.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.0 m-70 -130.65 141.37 50.42 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.977 1.311 . . . . 0.0 112.178 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 55.3 p-80 -156.64 167.46 30.38 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.91 1.684 . . . . 0.0 111.879 -175.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 23.5 p80 -146.1 151.63 38.0 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.151 1.381 . . . . 0.0 112.028 174.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -158.36 179.76 8.85 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.119 1.367 . . . . 0.0 112.295 -177.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 87.91 163.43 39.12 Favored Glycine 0 CA--C 1.539 1.533 0 C-N-CA 125.586 1.565 . . . . 0.0 116.0 170.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 34.6 t -154.04 150.62 28.42 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.981 1.712 . . . . 0.0 111.762 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -122.96 14.26 8.45 Favored Glycine 0 CA--C 1.538 1.473 0 C-N-CA 125.936 1.731 . . . . 0.0 114.715 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.25 -5.32 26.84 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 116.053 1.872 . . . . 0.0 116.053 -165.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 55.5 tp -69.64 -31.05 68.92 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.883 1.273 . . . . 0.0 112.454 178.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -87.36 147.95 25.24 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.706 0.802 . . . . 0.0 112.991 178.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -110.53 153.53 24.97 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 176.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.2 mt -128.67 149.97 50.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.627 1.571 . . . . 0.0 111.815 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -69.77 129.62 40.07 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.468 0.707 . . . . 0.0 109.908 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.44 -17.56 22.37 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -173.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.01 167.22 27.35 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.944 1.298 . . . . 0.0 112.942 -173.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.84 -165.95 54.74 Favored Glycine 0 CA--C 1.543 1.815 0 C-N-CA 124.032 0.825 . . . . 0.0 114.417 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -56.06 -28.41 69.47 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 123.982 3.121 . . . . 0.0 114.631 -174.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.39 3.22 54.57 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.042 1.337 . . . . 0.0 113.458 -176.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.3 125.83 11.76 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.141 0.882 . . . . 0.0 112.37 -179.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.22 -3.27 76.1 Favored Glycine 0 CA--C 1.53 0.983 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -177.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 36.4 mt -106.14 155.27 38.8 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 119.01 1.405 . . . . 0.0 112.452 -173.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -54.53 143.83 65.9 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.313 3.342 . . . . 0.0 112.585 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.8 t -78.15 -32.29 17.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 O-C-N 122.121 -0.362 . . . . 0.0 110.785 170.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 p -135.52 165.12 26.25 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.503 1.121 . . . . 0.0 113.422 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.0 ptm180 -58.75 -32.01 68.86 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.581 0.752 . . . . 0.0 112.821 171.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.5 m -71.17 -40.66 71.13 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.935 0.894 . . . . 0.0 111.704 174.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -62.07 -43.87 97.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 118.787 0.721 . . . . 0.0 110.561 172.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.83 -48.27 82.34 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.402 0.681 . . . . 0.0 111.991 177.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.4 ttm-85 -56.58 -46.07 80.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.856 1.262 . . . . 0.0 111.935 175.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 69.1 t -73.47 -34.15 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-O 118.376 -0.821 . . . . 0.0 112.08 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 38.4 mt -64.85 -44.84 88.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 120.524 1.511 . . . . 0.0 111.427 173.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.7 mt -62.18 -42.69 96.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.175 0.59 . . . . 0.0 110.338 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -60.93 -52.14 66.3 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 176.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -63.21 -39.6 95.09 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.332 0.653 . . . . 0.0 111.696 -178.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -59.89 -52.84 63.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.144 0.578 . . . . 0.0 111.004 173.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 78.1 t90 -55.16 -41.53 71.96 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.18 0.9 . . . . 0.0 112.864 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -65.43 -45.03 85.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 119.687 1.131 . . . . 0.0 111.878 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -65.99 -43.9 86.42 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 121.304 -0.872 . . . . 0.0 112.336 175.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -58.98 -48.29 82.11 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.058 0.543 . . . . 0.0 110.491 173.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -59.14 -33.55 71.02 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.519 1.128 . . . . 0.0 112.166 175.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -63.67 -44.67 93.07 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.919 0.888 . . . . 0.0 112.985 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 72.1 p -86.02 -28.38 24.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 -178.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -151.48 103.14 2.91 Favored Pre-proline 0 CA--C 1.557 1.226 0 C-N-CA 128.693 2.797 . . . . 0.0 109.832 -176.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.84 -13.74 24.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 123.94 3.093 . . . . 0.0 116.767 -160.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -67.28 -24.1 65.74 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.267 1.58 . . . . 0.0 115.267 -171.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 33.2 tp -63.78 144.85 56.72 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -161.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -96.69 149.89 21.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.251 1.42 . . . . 0.0 113.167 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.19 118.4 36.44 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.785 1.634 . . . . 0.0 109.213 -178.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -131.53 110.61 11.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.235 1.014 . . . . 0.0 112.07 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.08 55.2 0.99 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.193 1.397 . . . . 0.0 112.674 -179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 92.5 p -62.14 154.96 25.65 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.169 156.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.05 -32.09 70.59 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.48 -1.387 . . . . 0.0 111.284 178.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -57.33 -43.73 83.61 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.578 1.151 . . . . 0.0 112.457 167.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.02 -33.77 76.84 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.32 0.648 . . . . 0.0 112.652 174.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.28 -48.77 71.88 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 O-C-N 121.673 -0.642 . . . . 0.0 110.046 174.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.32 -29.53 69.12 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 118.437 0.562 . . . . 0.0 112.258 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 78.6 ttt180 -70.3 -45.19 66.77 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.602 1.161 . . . . 0.0 112.536 173.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -69.85 -37.41 76.14 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 118.658 0.663 . . . . 0.0 112.749 175.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -130.77 84.62 58.04 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 125.862 1.665 . . . . 0.0 110.475 -169.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -69.25 -12.86 34.85 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.307 2.671 . . . . 0.0 114.571 -168.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 36.7 p-80 -76.49 -11.56 59.9 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 175.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.21 -26.66 35.74 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 119.177 0.898 . . . . 0.0 112.818 177.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 128.03 2.532 . . . . 0.0 116.488 167.316 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mtp . . . . . 0 N--CA 1.498 1.932 0 CA-C-O 119.233 -0.413 . . . . 0.0 111.33 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -73.2 149.66 42.7 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.367 1.067 . . . . 0.0 111.696 177.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -163.06 175.08 39.43 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 124.935 1.255 . . . . 0.0 113.277 177.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 t -86.24 156.88 20.11 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.538 1.135 . . . . 0.0 112.604 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -137.35 155.62 49.19 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.961 1.705 . . . . 0.0 111.792 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.6 p-80 -139.66 149.49 43.79 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.028 1.331 . . . . 0.0 112.144 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.404 ' CG ' ' H ' ' A' ' 8' ' ' HIS . 1.9 t60 -154.8 -168.41 2.89 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.901 1.68 . . . . 0.0 110.501 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . 0.404 ' H ' ' CG ' ' A' ' 7' ' ' HIS . 86.7 m-70 57.13 75.11 0.38 Allowed 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.829 2.052 . . . . 0.0 114.164 169.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 58.5 m80 -77.83 40.36 0.31 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.42 1.488 . . . . 0.0 113.031 177.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.91 163.45 12.2 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 126.529 1.932 . . . . 0.0 113.183 -170.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -174.4 172.62 45.53 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.515 1.055 . . . . 0.0 113.638 175.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.5 p -146.31 158.61 43.9 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -175.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -79.44 173.0 55.2 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.316 0.96 . . . . 0.0 113.553 172.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.66 53.76 1.39 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.375 1.47 . . . . 0.0 113.04 -179.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 39.5 mt -75.12 -24.78 58.08 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.225 1.01 . . . . 0.0 113.485 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.58 145.67 54.65 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.72 153.92 32.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.419 1.488 . . . . 0.0 114.122 171.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.7 mt -122.42 149.88 43.22 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.633 1.573 . . . . 0.0 111.796 -178.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -69.05 141.43 54.8 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.897 0.879 . . . . 0.0 110.265 163.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -102.77 -17.71 15.46 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.894 1.442 . . . . 0.0 114.894 -173.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -139.33 160.22 40.33 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.645 1.178 . . . . 0.0 113.074 -170.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 71.04 -164.11 53.76 Favored Glycine 0 CA--C 1.541 1.667 0 C-N-CA 124.484 1.04 . . . . 0.0 114.45 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -59.79 -24.11 74.58 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.61 2.873 . . . . 0.0 113.812 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 mp -84.49 -6.17 59.35 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.759 1.624 . . . . 0.0 113.607 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.41 126.22 18.61 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.718 1.145 . . . . 0.0 112.23 -179.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 89.56 -1.11 81.26 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.0 mt -108.12 152.78 41.96 Favored Pre-proline 0 CA--C 1.552 1.05 0 CA-C-N 119.045 1.423 . . . . 0.0 112.363 -173.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -57.24 144.2 91.47 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 124.387 3.391 . . . . 0.0 113.23 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 40.8 t -80.48 -37.39 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 122.871 0.468 . . . . 0.0 111.537 178.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 9.8 t -139.05 168.92 18.76 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.356 1.462 . . . . 0.0 113.172 178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -58.21 -35.06 71.09 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.753 1.221 . . . . 0.0 111.446 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 25.0 m -61.0 -39.95 91.66 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.264 1.026 . . . . 0.0 112.503 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -67.11 -47.01 72.42 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.534 -0.729 . . . . 0.0 110.005 173.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.19 -42.4 90.8 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.734 0.697 . . . . 0.0 112.524 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.7 tmt_? -58.96 -49.03 79.39 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.059 1.743 . . . . 0.0 111.703 172.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.11 -35.44 63.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-O 118.632 -0.699 . . . . 0.0 112.346 178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.0 -48.64 79.42 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.069 1.304 . . . . 0.0 110.947 174.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.4 mt -63.01 -41.05 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 118.757 0.708 . . . . 0.0 110.94 176.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -55.14 37.74 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 122.957 0.503 . . . . 0.0 110.974 176.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -65.29 -36.03 82.83 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 120.828 -1.17 . . . . 0.0 112.682 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -56.85 -55.61 32.24 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.211 1.004 . . . . 0.0 110.935 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 56.3 t90 -51.85 -43.36 63.19 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.756 169.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -64.52 -46.93 80.8 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.731 1.15 . . . . 0.0 112.211 -173.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.03 -41.08 82.67 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.341 -0.849 . . . . 0.0 111.725 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.95 -50.46 73.98 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.581 -0.699 . . . . 0.0 111.098 172.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.9 tmtm? -58.09 -39.9 79.76 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.607 1.963 . . . . 0.0 112.702 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -64.69 -35.79 82.17 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 118.899 0.772 . . . . 0.0 112.423 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 6.5 t -77.05 -37.57 54.41 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 174.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -150.52 106.98 3.11 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 128.127 2.571 . . . . 0.0 109.796 -172.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.55 -12.59 22.53 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.463 3.442 . . . . 0.0 116.919 -159.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 10.5 p-90 -66.05 -25.02 66.85 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -174.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.1 tp -66.5 142.85 57.4 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -164.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 65.3 ttt180 -104.19 143.58 32.75 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 125.041 1.336 . . . . 0.0 111.949 175.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.42 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.9 OUTLIER -93.64 119.84 33.15 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 125.226 1.41 . . . . 0.0 109.78 -178.561 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -135.1 120.62 19.27 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.551 1.141 . . . . 0.0 111.609 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.42 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -152.01 52.17 0.8 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.72 1.208 . . . . 0.0 112.876 -176.153 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.7 m -68.02 161.29 27.01 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.267 164.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -52.15 -38.52 57.84 Favored 'General case' 0 N--CA 1.474 0.75 0 O-C-N 120.991 -1.068 . . . . 0.0 113.075 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -61.73 -39.07 90.24 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.068 0.947 . . . . 0.0 112.787 173.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.1 -39.32 89.89 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.828 0.74 . . . . 0.0 111.485 174.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -67.26 -46.07 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 CA-C-O 119.217 -0.42 . . . . 0.0 110.51 178.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -70.26 -30.09 67.05 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.479 0.581 . . . . 0.0 112.424 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -71.42 -40.24 70.56 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.748 0.819 . . . . 0.0 112.509 173.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 28.6 mmm-85 -68.93 -41.46 78.08 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.841 0.856 . . . . 0.0 112.127 173.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -136.38 90.57 17.48 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 125.576 1.55 . . . . 0.0 110.616 -168.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.13 -16.31 40.12 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 123.072 2.515 . . . . 0.0 114.795 -167.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -78.46 -6.51 55.54 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 177.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -85.95 -24.58 26.48 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 54.1 ttp180 . . . . . 0 C--O 1.252 1.205 0 CA-C-N 119.76 1.164 . . . . 0.0 112.542 179.262 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.6 ptt? . . . . . 0 N--CA 1.498 1.931 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -136.9 -48.91 0.62 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.773 1.229 . . . . 0.0 113.426 177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.3 -172.0 43.02 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.883 1.23 . . . . 0.0 113.207 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.6 m -128.88 145.26 51.26 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.024 1.33 . . . . 0.0 112.112 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 63.5 m80 -140.57 162.6 34.99 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.706 1.603 . . . . 0.0 112.026 -175.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -123.21 151.31 42.38 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.981 1.313 . . . . 0.0 111.987 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -134.31 17.79 3.7 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.162 1.385 . . . . 0.0 114.124 -168.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -83.7 120.08 25.56 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.415 -0.803 . . . . 0.0 112.64 -175.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -158.65 164.41 36.0 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 126.573 1.949 . . . . 0.0 110.806 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -117.03 -65.9 1.14 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.244 1.018 . . . . 0.0 111.121 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.71 -170.26 32.54 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 124.47 1.033 . . . . 0.0 115.525 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.4 m 56.19 23.41 7.0 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 126.422 1.889 . . . . 0.0 115.694 174.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -86.25 -1.08 86.52 Favored Glycine 0 CA--C 1.538 1.505 0 N-CA-C 115.834 1.094 . . . . 0.0 115.834 -174.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -147.11 169.88 18.35 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.003 1.321 . . . . 0.0 113.684 -172.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 pp -136.36 155.04 50.61 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.781 2.032 . . . . 0.0 113.778 -175.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -150.15 151.68 33.51 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.061 0.944 . . . . 0.0 113.015 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.72 156.19 29.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.568 1.547 . . . . 0.0 114.262 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 98.2 mt -128.81 149.87 50.55 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.579 1.552 . . . . 0.0 112.069 -177.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -69.82 132.32 45.86 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.978 0.911 . . . . 0.0 109.977 163.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -95.12 -24.34 16.9 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -175.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.11 163.85 31.86 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.072 1.349 . . . . 0.0 112.519 -171.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.18 -166.21 54.77 Favored Glycine 0 CA--C 1.541 1.673 0 C-N-CA 124.08 0.847 . . . . 0.0 114.494 176.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -55.99 -28.7 70.3 Favored 'Trans proline' 0 C--N 1.353 0.783 0 C-N-CA 124.043 3.162 . . . . 0.0 114.634 -174.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.2 mt -94.93 2.8 55.44 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.981 1.312 . . . . 0.0 113.478 -176.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.77 126.68 14.41 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 119.198 0.908 . . . . 0.0 112.328 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.89 -3.4 77.48 Favored Glycine 0 CA--C 1.53 1.027 0 N-CA-C 115.941 1.136 . . . . 0.0 115.941 -177.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.5 mt -107.59 155.17 40.16 Favored Pre-proline 0 CA--C 1.552 1.042 0 CA-C-N 119.068 1.434 . . . . 0.0 112.599 -172.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -55.34 144.07 73.59 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 124.333 3.355 . . . . 0.0 112.945 177.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 36.5 t -79.89 -32.95 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 O-C-N 122.147 -0.346 . . . . 0.0 110.848 172.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.0 p -133.37 164.11 27.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.899 1.28 . . . . 0.0 112.75 -176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 17.8 ptp180 -65.79 -25.78 67.4 Favored 'General case' 0 N--CA 1.481 1.086 0 O-C-N 120.912 -1.117 . . . . 0.0 112.843 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.8 t -68.27 -44.05 76.41 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.351 0.66 . . . . 0.0 111.098 170.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -59.17 -43.96 92.13 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.69 0.677 . . . . 0.0 110.643 172.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.92 -47.63 84.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.495 0.718 . . . . 0.0 112.638 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 70.0 mtp85 -58.44 -43.82 88.91 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.127 0.971 . . . . 0.0 111.903 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 92.1 t -73.86 -31.9 32.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 CA-C-O 118.614 -0.707 . . . . 0.0 112.523 179.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 37.7 mt -65.75 -42.57 90.75 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 120.659 1.572 . . . . 0.0 111.472 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -63.22 -41.79 94.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 118.52 0.6 . . . . 0.0 110.505 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -60.11 -50.16 74.78 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.76 -0.587 . . . . 0.0 112.312 174.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.83 -36.76 83.09 Favored 'General case' 0 CA--C 1.544 0.743 0 CA-C-N 118.77 0.714 . . . . 0.0 111.952 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 63.6 tt0 -59.51 -54.07 50.85 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.702 169.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -52.07 -43.65 63.95 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 119.218 0.917 . . . . 0.0 111.886 173.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -62.17 -48.67 79.02 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.834 0.853 . . . . 0.0 111.592 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.13 -44.59 79.45 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 121.539 -0.726 . . . . 0.0 112.335 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -57.33 -50.0 74.34 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.394 0.678 . . . . 0.0 110.363 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -59.52 -41.22 89.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.849 1.66 . . . . 0.0 112.333 177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? -64.12 -33.08 74.96 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.612 0.765 . . . . 0.0 112.529 174.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 70.5 m -82.19 -35.41 28.35 Favored 'General case' 0 N--CA 1.481 1.084 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -151.14 102.81 2.98 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 127.746 2.418 . . . . 0.0 109.732 -168.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.57 -12.8 24.83 Favored 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.241 3.294 . . . . 0.0 116.781 -158.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 13.2 p-90 -66.33 -25.4 66.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.39 1.626 . . . . 0.0 115.39 -172.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.0 tp -67.65 145.54 54.72 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 -161.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -101.75 149.47 24.13 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.458 1.503 . . . . 0.0 112.47 173.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -101.87 116.31 32.42 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.793 1.637 . . . . 0.0 109.191 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -135.51 117.63 15.44 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.637 1.175 . . . . 0.0 111.309 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.59 51.19 0.76 Allowed 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 25.9 t -66.94 159.58 28.15 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.235 0.614 . . . . 0.0 111.289 163.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -50.35 -38.37 41.81 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.809 1.244 . . . . 0.0 112.335 -179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.7 mttp -62.36 -39.26 92.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.121 0.969 . . . . 0.0 113.018 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.22 85.86 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.525 0.73 . . . . 0.0 111.611 173.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.65 -48.02 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 118.858 -0.591 . . . . 0.0 110.211 176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -67.01 -31.07 71.38 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.8 0.727 . . . . 0.0 112.212 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -68.65 -42.24 78.24 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.134 0.974 . . . . 0.0 112.787 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -71.72 -42.83 66.86 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 118.795 0.725 . . . . 0.0 112.763 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -130.68 81.24 68.1 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.04 1.736 . . . . 0.0 109.96 -163.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -68.14 -14.37 40.54 Favored 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.198 2.599 . . . . 0.0 114.528 -167.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 34.8 p-80 -74.95 -10.36 59.41 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 175.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -84.21 -26.87 28.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 119.471 1.032 . . . . 0.0 113.734 179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.23 0 CA-C-N 119.231 0.923 . . . . 0.0 111.587 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.4 tmm? . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -141.94 79.52 1.68 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.157 1.383 . . . . 0.0 111.063 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -73.99 159.14 52.61 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.351 0.976 . . . . 0.0 113.276 174.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.8 t -72.24 -37.48 69.13 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.425 0.69 . . . . 0.0 112.428 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.9 t-80 -150.72 150.6 31.25 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.871 1.668 . . . . 0.0 111.246 173.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -148.21 142.55 26.26 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.595 1.158 . . . . 0.0 111.54 171.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -82.6 84.54 7.23 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.026 0.93 . . . . 0.0 110.046 170.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -74.15 -22.81 59.28 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -174.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.7 p80 -65.56 149.26 50.36 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.872 1.269 . . . . 0.0 112.247 173.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -152.87 136.03 15.67 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.315 1.046 . . . . 0.0 111.676 177.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 67.08 178.29 10.21 Favored Glycine 0 CA--C 1.539 1.571 0 C-N-CA 124.35 0.976 . . . . 0.0 114.224 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -160.93 158.08 27.54 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.873 1.269 . . . . 0.0 111.758 172.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 178.21 157.74 19.54 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.399 1.0 . . . . 0.0 113.787 175.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -88.77 33.71 0.77 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 125.73 1.612 . . . . 0.0 113.505 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 pp -76.01 -13.47 60.23 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -170.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.84 136.15 53.66 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.559 0.743 . . . . 0.0 112.54 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -104.88 153.0 21.95 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 114.629 1.344 . . . . 0.0 114.629 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.5 mt -124.59 148.7 47.7 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.404 1.481 . . . . 0.0 112.021 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -69.88 141.6 53.14 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.804 0.842 . . . . 0.0 110.327 162.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.62 -13.3 15.08 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -172.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -138.51 158.15 44.82 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.679 1.191 . . . . 0.0 112.893 -171.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 69.25 -163.0 51.45 Favored Glycine 0 CA--C 1.541 1.717 0 C-N-CA 124.431 1.015 . . . . 0.0 114.487 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.37 -24.09 73.04 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.522 2.814 . . . . 0.0 113.952 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.63 -7.13 59.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.647 1.579 . . . . 0.0 113.647 178.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.77 125.14 15.87 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.806 1.185 . . . . 0.0 112.027 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 91.2 -1.21 76.67 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 116.117 1.207 . . . . 0.0 116.117 -177.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 30.0 mt -106.84 152.81 41.0 Favored Pre-proline 0 CA--C 1.549 0.938 0 CA-C-N 119.07 1.435 . . . . 0.0 112.452 -174.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -55.26 142.84 77.99 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 124.471 3.447 . . . . 0.0 112.866 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.3 t -78.02 -33.61 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 CA-C-O 119.437 -0.316 . . . . 0.0 110.746 172.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.8 p -133.38 164.67 26.59 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.649 1.18 . . . . 0.0 113.185 -175.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -32.77 70.25 Favored 'General case' 0 N--CA 1.481 1.075 0 O-C-N 121.314 -0.866 . . . . 0.0 112.337 172.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 23.5 m -71.41 -38.7 71.41 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.929 0.892 . . . . 0.0 111.656 176.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -61.68 -45.22 94.92 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.826 0.739 . . . . 0.0 110.341 170.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.85 -46.84 89.0 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.223 0.609 . . . . 0.0 112.273 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -57.16 -44.8 83.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.145 1.378 . . . . 0.0 112.001 175.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 77.0 t -76.57 -32.34 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-O 118.563 -0.732 . . . . 0.0 112.29 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 49.8 mt -62.57 -44.16 97.02 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 120.417 1.462 . . . . 0.0 111.067 169.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.8 mt -63.13 -40.8 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 CA-C-N 118.658 0.663 . . . . 0.0 111.026 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -61.36 -48.64 80.36 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.68 -0.637 . . . . 0.0 112.314 175.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -65.17 -39.61 93.14 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 118.722 0.692 . . . . 0.0 111.909 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -55.87 -56.64 18.21 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.755 1.222 . . . . 0.0 110.667 173.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -51.44 -47.11 63.17 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 118.317 -0.849 . . . . 0.0 112.45 171.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.6 -47.82 79.88 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.879 1.218 . . . . 0.0 112.375 -173.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.0 -43.8 86.67 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.526 -0.734 . . . . 0.0 111.812 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 76.7 mmt-85 -58.55 -52.96 63.42 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.844 -0.535 . . . . 0.0 110.998 175.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 15.3 tmtt? -54.73 -41.84 70.86 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 126.107 1.763 . . . . 0.0 112.613 177.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -67.6 -32.44 73.17 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.864 0.757 . . . . 0.0 112.806 174.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.3 t -78.07 -38.48 44.2 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 173.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -154.28 109.34 2.43 Favored Pre-proline 0 CA--C 1.554 1.108 0 C-N-CA 129.099 2.96 . . . . 0.0 109.482 -172.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.45 -13.72 22.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.182 3.255 . . . . 0.0 116.727 -160.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -67.43 -21.81 65.55 Favored 'General case' 0 N--CA 1.473 0.725 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -171.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.24 132.67 45.29 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.331 0.969 . . . . 0.0 110.81 -167.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -96.43 134.73 39.23 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 124.787 1.235 . . . . 0.0 112.413 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.411 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.8 OUTLIER -83.16 119.14 24.15 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.88 1.272 . . . . 0.0 110.117 179.891 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -137.07 121.33 18.03 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.832 1.253 . . . . 0.0 111.579 173.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.411 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -153.2 55.55 0.76 Allowed 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.638 1.175 . . . . 0.0 113.19 -177.886 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.9 t -63.82 153.27 37.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.464 158.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -54.9 -31.25 59.83 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.064 -1.022 . . . . 0.0 112.261 177.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -60.55 -41.5 94.64 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 123.871 0.869 . . . . 0.0 112.604 171.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.0 -37.64 88.34 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.776 0.83 . . . . 0.0 111.76 173.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 mp -66.26 -48.89 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 CA-C-O 119.243 -0.408 . . . . 0.0 110.348 176.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -67.93 -30.46 69.78 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 118.688 0.677 . . . . 0.0 112.247 -178.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.4 ttt180 -67.56 -45.03 76.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.208 1.003 . . . . 0.0 112.379 172.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 17.7 mtp180 -71.81 -36.09 70.15 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.427 0.691 . . . . 0.0 112.771 176.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -133.02 84.74 47.89 Favored Pre-proline 0 CA--C 1.548 0.89 0 C-N-CA 125.919 1.688 . . . . 0.0 110.506 -169.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -71.96 -9.13 24.2 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.397 2.731 . . . . 0.0 114.979 -167.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 32.8 p-80 -81.44 -7.39 59.57 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 176.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -81.69 -36.97 28.1 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.273 0.942 . . . . 0.0 113.122 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.293 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.736 175.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.499 1.997 0 CA-C-O 118.942 -0.551 . . . . 0.0 111.493 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -80.28 148.42 30.75 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 119.373 0.988 . . . . 0.0 111.378 176.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -78.43 -23.49 65.18 Favored Glycine 0 CA--C 1.537 1.464 0 C-N-CA 124.296 0.95 . . . . 0.0 114.899 -179.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.7 m -83.44 42.93 0.86 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.55 1.54 . . . . 0.0 113.115 -176.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -147.57 165.34 30.65 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.999 1.72 . . . . 0.0 111.984 -174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 57.99 28.05 15.68 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.13 1.772 . . . . 0.0 114.073 176.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.6 p-80 -90.94 -8.92 47.95 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 126.627 1.971 . . . . 0.0 114.486 -175.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 53.2 t60 -112.31 135.33 53.13 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.394 1.478 . . . . 0.0 111.887 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -141.04 142.17 34.23 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.229 1.412 . . . . 0.0 111.595 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -152.38 -173.12 4.44 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.066 1.347 . . . . 0.0 112.008 -178.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.27 157.13 15.84 Favored Glycine 0 CA--C 1.537 1.46 0 C-N-CA 123.943 0.783 . . . . 0.0 114.394 177.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.1 p -146.62 -29.5 0.38 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -176.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 79.99 156.9 12.88 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 124.643 1.116 . . . . 0.0 114.662 -179.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -85.98 44.45 1.13 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.571 1.548 . . . . 0.0 113.729 -171.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.2 pp -78.32 -14.06 59.58 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 -173.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -70.24 144.3 51.89 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.018 0.927 . . . . 0.0 112.918 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -105.75 153.06 22.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.887 1.44 . . . . 0.0 114.887 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 96.9 mt -127.9 149.94 50.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.675 1.59 . . . . 0.0 111.977 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -70.19 131.04 43.63 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.602 0.761 . . . . 0.0 109.848 162.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -93.5 -25.18 17.71 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 -175.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -141.36 164.55 29.95 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.307 1.443 . . . . 0.0 112.438 -171.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 75.29 -165.47 54.57 Favored Glycine 0 CA--C 1.542 1.751 0 C-N-CA 124.157 0.884 . . . . 0.0 114.542 177.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -56.33 -28.51 72.5 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 124.066 3.178 . . . . 0.0 114.648 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.0 mt -95.9 3.49 53.55 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.002 1.321 . . . . 0.0 113.519 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -49.37 126.03 12.3 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 119.098 0.863 . . . . 0.0 112.45 -179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 92.0 -2.96 76.58 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.79 1.186 . . . . 0.0 116.013 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 38.7 mt -107.49 154.66 40.59 Favored Pre-proline 0 CA--C 1.551 0.995 0 CA-C-N 118.996 1.398 . . . . 0.0 112.657 -172.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -54.98 143.72 71.57 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.574 3.516 . . . . 0.0 112.925 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 35.5 t -79.05 -32.56 15.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.077 -0.389 . . . . 0.0 111.009 172.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 2.4 p -133.77 164.36 27.4 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.862 1.265 . . . . 0.0 112.491 -176.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.62 -26.58 68.46 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 120.914 -1.116 . . . . 0.0 112.808 172.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 16.2 t -68.19 -42.32 80.09 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.278 0.631 . . . . 0.0 111.169 171.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -61.25 -44.34 97.41 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 121.306 -0.871 . . . . 0.0 110.814 172.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.52 -47.16 87.39 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.371 0.668 . . . . 0.0 112.437 178.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 75.5 ttt-85 -58.09 -45.92 86.36 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.307 1.443 . . . . 0.0 111.833 175.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 78.4 t -74.2 -33.7 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-O 118.553 -0.737 . . . . 0.0 112.297 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 42.6 mt -62.42 -46.34 88.99 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 120.235 1.38 . . . . 0.0 111.192 171.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 82.4 mt -61.55 -43.41 96.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 118.461 0.573 . . . . 0.0 110.798 174.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.62 -51.81 67.82 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.577 0.751 . . . . 0.0 112.267 177.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -69.09 -34.51 75.23 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 121.137 -0.977 . . . . 0.0 112.198 -178.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -62.81 -50.87 69.29 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.374 0.67 . . . . 0.0 111.395 171.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 58.2 t90 -51.65 -44.58 63.05 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-N 119.043 0.838 . . . . 0.0 111.638 170.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.12 -46.38 87.55 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.396 0.998 . . . . 0.0 111.6 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -60.86 -47.99 83.85 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.566 0.747 . . . . 0.0 112.459 174.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -60.62 -51.34 69.83 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.573 -0.704 . . . . 0.0 111.201 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -62.32 -31.92 72.61 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 125.271 1.428 . . . . 0.0 112.914 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 39.5 tptt -60.96 -45.68 93.78 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 119.7 1.137 . . . . 0.0 112.345 165.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 7.1 t -77.7 -35.41 52.17 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 114.692 1.368 . . . . 0.0 114.692 -177.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -147.78 105.79 3.7 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 128.666 2.786 . . . . 0.0 108.946 -172.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -73.24 -14.28 25.66 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 123.901 3.067 . . . . 0.0 116.732 -157.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -68.47 -24.05 64.66 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 115.574 1.694 . . . . 0.0 115.574 -171.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 23.7 tp -68.66 140.4 55.46 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -163.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 -98.13 153.95 18.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.92 1.288 . . . . 0.0 112.928 170.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 101' ' ' MET . 0.5 OUTLIER -101.09 118.53 37.18 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.912 1.685 . . . . 0.0 109.329 178.539 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -135.93 119.44 16.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.492 1.117 . . . . 0.0 111.323 178.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' MET . . . . . 0.415 ' HG3' ' CD2' ' A' ' 99' ' ' LEU . 0.0 OUTLIER -155.67 52.04 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 122.456 1.122 . . . . 0.0 113.377 -173.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 41.5 m -67.64 159.45 29.93 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.298 163.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -53.46 -37.0 62.24 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.094 -1.003 . . . . 0.0 112.596 -178.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -61.86 -38.73 89.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.684 0.794 . . . . 0.0 113.06 173.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -66.05 -40.59 91.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.994 0.815 . . . . 0.0 111.036 173.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.7 mp -66.35 -47.69 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 CA-C-O 119.177 -0.44 . . . . 0.0 110.464 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -67.97 -31.14 70.64 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 118.632 0.651 . . . . 0.0 112.568 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -70.12 -40.7 74.7 Favored 'General case' 0 N--CA 1.476 0.846 0 O-C-N 121.452 -0.78 . . . . 0.0 112.667 174.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -77.1 -33.49 56.93 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 176.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -133.41 83.65 48.93 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 125.923 1.689 . . . . 0.0 110.338 -171.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -69.43 -12.68 34.07 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 123.253 2.635 . . . . 0.0 114.563 -169.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 39.0 p-80 -77.49 -7.19 55.84 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.74 -30.49 21.59 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.281 0.946 . . . . 0.0 113.41 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.227 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 172.359 . . . . . . . . 1 1 . 1 stop_ save_